Wikidata:Database reports/Constraint violations/P2057
Constraint violations report for Human Metabolome Database ID (Discussion, uses, items, changes, related properties): ID in Human Metabolome Database
Data time stamp: (UTC) — Items processed: 46,101
The report is generated based on the settings on Property:P2057#P2302.
Updates overwrite this page. Some may already be fixed since the last update: check RecentChangesLinked.
When incremental dumps and the bot work as planned, items fixed before 07:00 UTC disappear in the next update. The report is not updated if only the item count changes.
The report can include false positives. There is no need to "fix" them.
Data time stamp: (UTC) — Items processed: 46,101
The report is generated based on the settings on Property:P2057#P2302.
Updates overwrite this page. Some may already be fixed since the last update: check RecentChangesLinked.
When incremental dumps and the bot work as planned, items fixed before 07:00 UTC disappear in the next update. The report is not updated if only the item count changes.
The report can include false positives. There is no need to "fix" them.
"Unique value" violations edit
Violations count: 725
- HMDB0000008: (RS)-2-hydroxybutyric acid (Q3288610), (S)-2-hydroxybutyric acid (Q27887417)
- HMDB0000021: 3-iodo-L-tyrosine (Q410703), 3-iodo-L-tyrosine zwitterion (Q106345638)
- HMDB0000033: carnosine (Q413822), carnosine zwitterion (Q106345643)
- HMDB0000038: Dihydrobiopterin (Q5276421), L-erythro-7,8-dihydrobiopterin (Q27104501)
- HMDB0000043: betaine (Q10860583), Trimethyl Glycine (Q27095239)
- HMDB0000048: 6-O-alpha-D-galactopyranosyl-alpha-D-glucopyranose (Q27463256), melibiose (Q74411440)
- HMDB0000055: Cellobiose (Q409017), beta-cellobiose (Q27104340)
- HMDB0000056: β-alanine (Q310919), beta-alanine zwitterion (Q106345620)
- HMDB0000064: creatine (Q223600), creatine zwitterion (Q106345487)
- HMDB0000078: L-cysteinylglycine (Q27106297), L-cysteinylglycine zwitterion (Q106345566)
- HMDB0000079: dihydrothymine (Q3027885), (5S)-dihydrothymine (Q27271101)
- HMDB0000086: sn-glycero-3-phosphocholine (Q28529699), L-alpha-Glycerylphosphorylcholine (GPC) (Q60476027)
- HMDB0000092: N,N-dimethylglycine (Q4369), N,N-dimethylglycine zwitterion (Q106345659)
- HMDB0000098: α-D-xylopyranose (Q212774), D-xylopyranose (Q74410731)
- HMDB0000099: L-cystathionine (Q28529685), L-cystathionine dizwitterion (Q106345609)
- HMDB0000112: γ-aminobutyric acid (Q210021), gamma-aminobutyric acid zwitterion (Q106345483)
- HMDB0000122: aldehydo-D-glucose (Q21036645), β-D-glucopyranose (Q23905968)
- HMDB0000123: glycine (Q620730), glycine zwitterion (Q106345678)
- HMDB0000126: glyceryl 1-phosphate (Q2739882), (R)-glyceryl 1-phosphate (Q27093499)
- HMDB0000128: glycocyamine (Q2740979), guanidinoacetic acid zwitterion (Q106345629)
- HMDB0000158: L-tyrosine (Q188017), L-tyrosine zwitterion (Q106345477)
- HMDB0000159: phenylalanine (Q170545), L-phenylalanine zwitterion (Q106345467)
- HMDB0000161: L-Alanine (Q218642), L-alanine zwitterion (Q106345485)
- HMDB0000162: L-proline (Q20035886), L-proline zwitterion (Q106345478)
- HMDB0000167: L-Threonine (Q186521), L-threonine zwitterion (Q106345476)
- HMDB0000168: L-Asparagine (Q29519883), L-asparagine zwitterion (Q106345612)
- HMDB0000169: D-mannopyranose (Q335208), α-D-mannopyranose (Q27103868)
- HMDB0000172: L-isoleucine (Q484940), L-isoleucine zwitterion (Q106345669)
- HMDB0000174: L-fucopyranose (Q409082), α-L-fucopyranose (Q27095250)
- HMDB0000177: L-histidine (Q485277), L-histidine zwitterion (Q106345670)
- HMDB0000181: levodopa (Q300989), L-dopa zwitterion (Q106345614)
- HMDB0000187: L-serine (Q183290), L-serine zwitterion (Q106345473)
- HMDB0000192: L-cystine (Q408626), L-cystine zwitterion (Q106345631)
- HMDB0000194: anserine (Q415335), anserine zwitterion (Q106345649)
- HMDB0000206: N6-Acetyllysine (Q4673311), N(6)-acetyl-L-lysine zwitterion (Q106345663)
- HMDB0000210: pantothenic acid (Q179894), D-Pantothenic acid (Q63390527)
- HMDB0000217: NADP+ (Q26987754), NADP zwitterion (Q71530982)
- HMDB0000227: (R)-mevalonic acid (Q241678), (RS)-mevalonate (Q27088641)
- HMDB0000229: nicotinamide ribotide (Q21547155), NMN(+) (Q27108984)
- HMDB0000240: sulfurous acid (Q206778), sulfite ion (Q413363)
- HMDB0000248: L-thyroxine (Q773449), L-thyroxine zwitterion (Q106345689)
- HMDB0000250: pyrophosphate anion (Q290828), pyrophosphoric acid (Q411092)
- HMDB0000251: taurine (Q207051), taurine zwitterion (Q106345481)
- HMDB0000257: thiosulfate ion (Q410739), thiosulfuric acid (Q420074)
- HMDB0000265: triiodothyronine (Q327362), 3,3',5-triiodo-L-thyronine zwitterion (Q106345628)
- HMDB0000267: (R)-pyroglutamic acid (Q421383), (S)-pyroglutamic acid (Q60998677)
- HMDB0000271: sarcosine (Q414157), sarcosine zwitterion (Q106345645)
- HMDB0000291: hydroxy(4-hydroxy-3-methoxyphenyl)acetic acid (Q901369), L-(+)-vanilmandelic acid (Q27289848)
- HMDB0000301: urocanic acid (Q30536), trans-urocanic acid (Q60998685)
- HMDB0000302: UDP-α-D-galactose (Q259015), UDP-D-galactose (Q27102985)
- HMDB0000304: UDP-N-acetylgalactosamine (Q27089067), Uridine diphosphate-N-acetylgalactosamine (Q105151172)
- HMDB0000387: 3-hydroxylauric acid (Q27073732), (S)-3-hydroxylauric acid (Q27116740)
- HMDB0000402: (2S)-2-isopropylmalate(2-) (Q27105419), (2S)-2-hydroxy-2-propan-2-ylbutanedioic acid (Q76280927)
- HMDB0000440: 3-hydroxybenzeneacetic acid (Q10395566), 3-hydroxyphenylacetate (Q27125403)
- HMDB0000446: N-acetyllysine (Q27104319), N(2)-acetyl-L-lysine zwitterion (Q106345559)
- HMDB0000472: 5-HTP (Q238544), 5-hydroxy-L-tryptophan zwitterion (Q106345490)
- HMDB0000489: N(4)-(beta-N-acetyl-D-glucosaminyl)-L-asparagine (Q4807723), N(4)-(beta-N-acetyl-D-glucosaminyl)-L-asparagine zwitterion (Q106345664)
- HMDB0000491: 3-ethyl-3-methylpyruvic acid (Q23905808), (3S)-3-methyl-2-oxo-pentanoic acid (Q27452360)
- HMDB0000510: α-aminoadipic acid (Q2823204), L-2-aminoadipic acid (Q27104392)
- HMDB0000522: 3-methylglutaconic acid (Q2823219), (E)-3-methylpent-2-enedioic acid (Q76144140)
- HMDB0000525: (5R)-5-hydroxyhexanoic acid (Q27147992), 5-hydroxyhexanoic acid (Q106038793)
- HMDB0000528: DL-hydroorotic acid (Q2823223), L-dihydroorotic acid (Q106615400)
- HMDB0000529: 5-dodecenoic acid (Q27156594), cis-5-dodecenoic acid (Q27159277)
- HMDB0000562: creatinine (Q426660), creatinine tautomer (Q28529684)
- HMDB0000564: DL-dipalmitoylphosphatidylcholine (Q2587934), colfosceril palmitate (Q5144764)
- HMDB0000574: L-Cysteine (Q186474), L-cysteine zwitterion (Q106345475)
- HMDB0000575: (2S,2′S)-homocystine (Q24188398), DL-homocystine (Q58879461), (2S,2′S)-homocystine zwitterion (Q102047821)
- HMDB0000595: carbonic acid (Q104334), bicarbonate ion (Q409202)
- HMDB0000600: 5-(beta-D-galactosyloxy)-L-lysine (Q27104414), Galactosylhydroxylysine (Q106029177)
- HMDB0000601: 3Alpha,7Alpha,12Alpha-trihydroxy-5Beta-cholestan-26-oic acid (Q27103052), 3alpha,7alpha,12alpha-trihydroxy-5beta-cholestan-26-oate(1-) (Q27158698)
- HMDB0000629: chondroitin (Q4862650), beta-D-GlcpA-(1->3)-beta-D-GalpNAc (Q27130572)
- HMDB0000641: L-glutamine (Q181619), L-glutamine zwitterion (Q106345471)
- HMDB0000646: L-arabinopyranose (Q27102447), β-L-arabinopyranose (Q27120409)
- HMDB0000650: DL-α-aminobutyric acid (Q285687), D-α-aminobutyric acid (Q113300938)
- HMDB0000651: decanoyllevocarnitine (Q27103858), (+/-)-decanoylcarnitine (Q27137205)
- HMDB0000656: oxiglutatione (Q3324838), cysteineglutathione disulfide (Q106026568)
- HMDB0000660: β-D-fructofuranose (closed ring structure) (Q27103808), keto-L-fructose (Q27117239)
- HMDB0000670: L-homoarginine(1+) (Q27094832), L-homoarginine (Q57828472)
- HMDB0000671: (S)-indole-3-lactic acid (Q27095975), indole-3-lactic acid (Q27109857)
- HMDB0000675: iodine (Q1103), diiodine (Q2064483)
- HMDB0000679: L-homocitrulline (Q18207833), L-homocitrulline zwitterion (Q106345472)
- HMDB0000684: L-kynurenine (Q415768), L-kynurenine zwitterion (Q106345652)
- HMDB0000687: L-leucine (Q483745), L-leucine zwitterion (Q106345666)
- HMDB0000688: isovaleryl-L-carnitine (Q27139117), O-isovalerylcarnitine (Q27140242)
- HMDB0000696: L-methionine (Q22124685), L-methionine zwitterion (Q106345486)
- HMDB0000703: (RS)-mandelic acid (Q412293), (S)-mandelic acid (Q27096314)
- HMDB0000713: isolithocholic acid (Q27105090), (4R)-4-[(3S,5S,8R,9S,10S,13R,14S,17R)-3-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid (Q63399713)
- HMDB0000716: (-)-pipecolic acid (Q27104171), L-pipecolic acid zwitterion (Q106345557)
- HMDB0000719: L-homoserine (Q418214), L-homoserine zwitterion (Q106345654)
- HMDB0000725: hydroxyproline (Q12460151), trans-4-hydroxy-L-proline zwitterion (Q106345465)
- HMDB0000734: (E)-3-(indol-2-yl)acrylic acid (Q27162470), 3-indolylacrylic acid (Q27225487)
- HMDB0000742: DL-homocysteine (Q192466), L-homocysteine (Q26992833), L-homocysteine zwitterion (Q106345493)
- HMDB0000745: L-homocarnosine (Q27158831), L-homocarnosine zwitterion (Q106314674)
- HMDB0000764: 3-phenyl propionic acid (Q4358522), 3-phenylpropionate (Q27104780)
- HMDB0000824: O-propanoylcarnitine (internal charge) (Q27103933), Levocarnitine propionate (Q27104808)
- HMDB0000828: DL-N-carbamoylaspartic acid (Q2823324), N-carbamoyl-L-aspartic acid (Q55177068)
- HMDB0000845: D-(+)-neopterin (Q908292), neopterin (Q104667932)
- HMDB0000849: rhamnose (aldehydo) (Q414109), L-rhamnopyranose (Q74411108)
- HMDB0000866: N-acetyl-L-tyrosine (Q27109405), N-acetyltyrosine (Q27137011)
- HMDB0000883: L-valine (Q483752), L-valine zwitterion (Q106345667)
- HMDB0000902: NAD+ (Q26987253), NAD zwitterion (Q71535049)
- HMDB0000903: tetrahydrocortisone (Q7706546), allopregnane-3β,17α,21-triol-11,20-dione (Q27294236)
- HMDB0000904: L-citrulline (Q408641), L-citrulline zwitterion (Q106345633)
- HMDB0000908: epidihydrocholesterin (Q27114383), dihydrocholesterol (Q27159255)
- HMDB0000929: tryptophan (Q181003), L-tryptophan zwitterion (Q106345470)
- HMDB0000939: S-adenosyl-L-homocysteine (Q307434), S-adenosyl-L-homocysteine zwitterion (Q106345616)
- HMDB0000943: L-threonic acid (Q3270244), D-threonic acid (Q27121459)
- HMDB0000965: hypotaurine (Q3138539), hypotaurine zwitterion (Q106345623)
- HMDB0000992: 4-oxo-4-(pyridin-3-yl)butanoate (Q27135530), 4-oxo-4-(pyridin-3-yl)butanoic acid (Q27135538)
- HMDB0001031: 2-deoxy-D-ribose 5-phosphate (Q27098393), 2'-deoxy-ribofuranose-5'-monophosphate (Q27457178)
- HMDB0001041: 2-methylbutanoyl-CoA (Q27089462), (S)-2-methylbutanoyl-CoA (Q27105127)
- HMDB0001046: cotinine (Q421177), (+-)-Cotinine (Q81984445)
- HMDB0001050: hypochlorous acid (Q407318), hypochlorite ion (Q409049)
- HMDB0001052: (S)-3-hydroxyisobutyryl-CoA (Q27103588), 3-Hydroxyisobutyryl-CoA (Q115966025)
- HMDB0001057: trans-3-methylglutaconyl-CoA (Q27089472), 3-methylglutaconyl-CoA (Q32039062)
- HMDB0001058: beta-fructose 1,6-bisphosphate (Q414945), Fructose-1,6-diphosphate (Q27104462)
- HMDB0001059: IP4 (Q27078094), Inositol 1,3,4,5-Tetrakisphosphate (Q27092989)
- HMDB0001066: S-Lactoylglutathione (Q15304712), (R)-S-lactoylglutathione (Q63395383)
- HMDB0001068: sedoheptulose 7-phosphate (Q3040325), alpha-D-sedoheptulopyranose 7-phosphate (Q106030373)
- HMDB0001076: D-fructofuranose 1-phosphate (Q27104412), beta-D-fructofuranose-1-phosphate (Q76640893)
- HMDB0001078: D-mannopyranose 6-phosphate (Q259546), β-D-mannose 6-phosphate (Q27104716)
- HMDB0001084: 1-piperideine-2-carboxylic acid (Q27104170), 1-piperideine-6-carboxylic acid (Q27104644), 1-piperideine-2-carboxylic acid zwitterion (Q106345556)
- HMDB0001087: S-methyl-5-thio-D-ribose (Q27102131), (2R,3R,4S,5S)-5-(methylsulfanylmethyl)oxolane-2,3,4-triol (Q76100157)
- HMDB0001088: butyryl-CoA (Q2929006), S-[2-[3-[[4-[[[5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethyl] butanethioate (Q42412398)
- HMDB0001112: 3-phosphoglyceraldehyde (Q794810), D-glyceraldehyde-3-phosphate (Q26992303)
- HMDB0001129: N-Acetylmannosamine (Q6951351), N-acetyl-D-mannosamine (Q27132427)
- HMDB0001138: N-acetyl-L-glutamate(2-) (Q27104528), N-acetyl-L-glutamic acid (Q63390524)
- HMDB0001139: prostaglandin F2α (Q421375), (E)-7-[(1R,2R,3R,5S)-3,5-dihydroxy-2-[(E,3S)-3-hydroxyoct-1-enyl]cyclopentyl]hept-5-enoic acid (Q63398817)
- HMDB0001143: (1s,3s,4s)-1,3,4-Triphospho-Myo-Inositol (Q27092892), inositol 1,3,4-trisphosphate (Q33129821)
- HMDB0001149: aminolevulinic acid (Q238474), 5-ammoniolevulinate (Q106345489)
- HMDB0001161: 4-trimethylammoniobutanoate (Q27073962), 4-(trimethylammonio)butanoic acid (Q27105530)
- HMDB0001178: adenosine diphosphate ribose (Q61416), ADP ribose (Q110012365)
- HMDB0001185: S-adenosylmethionine (Q27135598), S-adenosyl-L-methionine (Q56071634), S-Adenosylmethionine(1+, zwitterion) (Q106314841)
- HMDB0001188: (S)-2,3-epoxysqualene (Q27453274), (3S)-2,2-dimethyl-3-[(3Z,7E,11Z,15E)-3,7,12,16,20-pentamethylhenicosa-3,7,11,15,19-pentaen-1-yl]oxirane (Q33108774)
- HMDB0001200: N-formylkynurenine (Q71982), N-formyl-L-kynurenine (Q27104120)
- HMDB0001229: dopaquinone (Q11694846), L-dopaquinone zwitterion (Q106315140)
- HMDB0001247: aluminium (Q663), aluminum cation (Q27104698)
- HMDB0001262: maltotriose (Q249208), alpha-D-Glcp-(1->4)-alpha-D-Glcp-(1->4)-D-Glcp (Q74418020)
- HMDB0001263: allysine (Q61298), L-allysine (Q28529674), L-allysine zwitterion (Q106345607)
- HMDB0001269: methylmalonyl-CoA (Q417791), CH3-malonyl-CoA (Q82096586)
- HMDB0001270: DL-glyceric acid 1,3-biphosphate (Q1020557), 3-phospho-D-glyceroyl dihydrogen phosphate (Q27098334)
- HMDB0001275: propionyl-CoA (Q2640914), Propionyl-CoA (Q59652821)
- HMDB0001280: 2-aminomuconic semialdehyde (Q2823203), 2-aminomuconic 6-semialdehyde zwitterion (Q106345602)
- HMDB0001294: 2,3-diphosphoglyceric acid (Q209155), 2,3-bisphospho-D-glyceric acid (Q27102555)
- HMDB0001296: maltotetraose (Q27096312), Amylotetraose (Q74417077)
- HMDB0001301: 1-pyrroline-5-carboxylic acid (Q2823196), (S)-1-pyrroline-5-carboxylic acid (Q27105294)
- HMDB0001302: molybdenum (Q1053), Molybdenum ion(2+) (Q81977201)
- HMDB0001310: D-Alanine (Q27076975), D-alanine zwitterion (Q106345495)
- HMDB0001315: phosphorus (Q674), red phosphorus (Q457556)
- HMDB0001325: trimethyl-L-lysine (Q28529719), N-6-Trimethyllysine (Q106029410)
- HMDB0001328: dTDP-D-glucose (Q27116445), 2'Deoxy-thymidine-5'-diphospho-alpha-D-glucose (Q76100248)
- HMDB0001330: 2-amino-3-carboxymuconic semialdehyde (Q2823201), 2-amino-3-carboxymuconic semialdehyde (Q27109180)
- HMDB0001349: selenium (Q876), selenium(2+) (Q27129117)
- HMDB0001358: retinal (Q422001), all-trans-retinal (Q28529715)
- HMDB0001362: dihydrogen (Q3027893), tritium deuteride (Q121336691)
- HMDB0001367: N-acetyl-alpha-D-glucosamine 1-phosphate (Q27101910), 2-acetamido-2-deoxy-D-glucopyranose 1-phosphate (Q27107444)
- HMDB0001370: (S,S)-2,6-diaminopimelic acid (Q27094515), (2S,6S)-2,6-diaminopimelic acid dizwitterion (Q106345507)
- HMDB0001375: (3S)-3-hydroxy-3-methylglutaryl-CoA (Q307532), 3-hydroxy-3-methylglutaryl-CoA (Q27108899)
- HMDB0001390: trans-3-hydroxycotinine (Q27139424), Hydroxycotinine (Q82252225)
- HMDB0001394: heparin (Q190016), (2R,3S,4S,5R,6R)-6-[(2R,3S,4R,5R,6S)-4,6-dihydroxy-5-(sulfoamino)-2-(sulfooxymethyl)oxan-3-yl]oxy-3,4-dihydroxy-5-sulfooxyoxane-2-carboxylic acid (Q76411557)
- HMDB0001413: CDP-choline (1+) (Q421308), CDP-choline (neutral charge) (Q28529682)
- HMDB0001416: 4'-phosphopantetheine (Q6590391), (±)-pantetheine 4'-phosphate (Q27102113)
- HMDB0001429: phosphate(3−) ion (Q177811), phosphoric acid (Q184782)
- HMDB0001430: L-dopachrome (Q27098224), (2S)-5,6-dioxo-2,4-dihydro-1H-indole-2-carboxylic acid (Q47459671)
- HMDB0001434: 3-O-methyldopa (Q15410220), DL-3-O-methyldopa (Q23570653)
- HMDB0001443: phosphorous acid (Q407743), phosphite ion (Q2496351)
- HMDB0001448: sulfuric acid (Q4118), sulfate ion (Q172290)
- HMDB0001475: zirconium (Q1038), zirconium cation (4+) (Q27271432)
- HMDB0001496: 7alpha-hydroxycholesterol (Q155744), 7alpha-Hydroxycholesterol (Q27161467)
- HMDB0001512: thiamine triphosphate (Q3523978), thiamine(1+) triphosphate (Q27108430)
- HMDB0001534: 5-formiminotetrahydrofolic acid (Q2823229), 5-formimidoyltetrahydrofolic acid (Q27098161)
- HMDB0001548: alpha-D-ribofuranose 5-phosphate (Q27102887), D-ribofuranose 5-phosphate (Q27123582)
- HMDB0001562: levoleucovorin (Q192464), (6R)-Folinic acid (Q27094183)
- HMDB0001586: α-D-glucose-1-phosphate (Q418865), D-glucopyranose 1-phosphate (Q27098367)
- HMDB0001644: beta-D-xylulofuranose (Q27467574), D-xylulose (Q28529722)
- HMDB0001645: L-norleucine (Q415428), L-2-aminohexanoic acid zwitterion (Q106345651)
- HMDB0001721: O-phospho-L-serine (Q2701649), P-serine (Q104950626)
- HMDB0001867: aminohippuric acid (Q291271), p-aminohippurate (Q27133388)
- HMDB0001881: (RS)-propylene glycol (Q161495), (R)-propylene glycol (Q27093218)
- HMDB0001885: DL-3-chlorotyrosine (Q27073727), 3-chlorotyrosine (Q27124161)
- HMDB0001886: 3-methyl-9H-xanthine (Q27888118), 3-methyl-7H-xanthine (Q74418326)
- HMDB0001901: aminocaproic acid (Q255968), 6-aminohexanoic acid zwitterion (Q106345491)
- HMDB0001920: dextromethorphan (Q407781), levomethorphan (Q60998690)
- HMDB0001930: ranitidine (Q423037), (E)-ranitidine (Q21971328)
- HMDB0001934: nicotine (Q12144), (−)-nicotine (Q28086552)
- HMDB0001935: (RS)-warfarin (Q407431), rac-warfarin (Q113368879)
- HMDB0001937: rac-salbutamol (Q410358), (RS)-salbutamol (Q93346928)
- HMDB0001959: Gamma-Aminobutyryl-lysine (Q27161495), (2S)-6-amino-2-(4-aminobutanoylamino)hexanoic acid (Q76511922)
- HMDB0001964: trans-caffeic acid (Q414116), cis-caffeic acid (Q27102378)
- HMDB0001966: titanium (Q716), titanium cation (4+) (Q27268742)
- HMDB0002005: DL-methionine (RS)-S-oxide (Q6823656), L-methionine (RS)-S-oxide (Q27102175)
- HMDB0002006: (+)-2,3-diaminopropionic acid (Q17097143), 3-amino-L-alanine zwitterion (Q106345469)
- HMDB0002014: (5Z)-tetradecenoylcarnitine (Q27140269), O-[(5Z)-tetradecenoyl]-L-carnitine (Q27157963)
- HMDB0002031: 3-ureidoisobutyric acid (Q2823221), (2S)-3-(carbamoylamino)-2-methylpropanoic acid (Q27466953)
- HMDB0002040: 4-methoxycinnamic acid (Q27121258), 4-Methoxycinnamic acid (Q63391599)
- HMDB0002050: dihydroxyfumaric acid (Q27106417), 2-oxo-3,4,4-trihydroxy-3E-butenoic acid (Q120204833)
- HMDB0002072: anisyl acetate (Q2823825), 4-methoxyphenylacetic acid (Q63398108)
- HMDB0002080: petroselinic acid (Q2080732), octadec-6-enoic acid (Q27116669)
- HMDB0002098: 2'-fucosyllactose (open form) (Q4596726), alpha-L-Fucp-(1->2)-beta-D-Galp-(1->4)-D-GlcpNAc (Q27131728)
- HMDB0002104: glutamate-5-semialdehyde (Q2823261), L-glutamic 5-semialdehyde zwitterion (Q106345606)
- HMDB0002108: S-methylcysteine (Q27093260), S-methyl-D-cysteine (Q27449867)
- HMDB0002113: trans-3-hydroxy-L-proline (Q23804983), cis-3-hydroxy-D-proline (Q27159975)
- HMDB0002145: cis-dec-4-enoyl-CoA (Q27109958), S-[2-[3-[[(2R)-4-[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethyl] (E)-dec-4-enethioate (Q76386913)
- HMDB0002166: (S)-3-aminoisobutyric acid (Q27088673), (S)-3-aminoisobutyric acid zwitterion (Q106345499)
- HMDB0002177: bishomostearidonic acid (Q27139653), all-cis-8,11,14,17-icosatetraenoate (Q27139713)
- HMDB0002179: peroxynitrite ion (Q419130), peroxynitrous acid (Q7169514)
- HMDB0002219: glycitin (Q27149383), glycitein 7-O-glucoside (Q105203653)
- HMDB0002237: 3,4-dimethylbenzoic acid (Q27133457), 3,4-dimethylbenzoate (Q27133462)
- HMDB0002275: D-(+)-neopterin (Q908292), 7,8-dihydroneopterin (Q28487686)
- HMDB0002277: 2,3-dinor-6-oxoprostaglandin F1alpha (Q27144266), 2,3-Dinor-6-keto-prostaglandin F1a (Q106039037)
- HMDB0002281: 4a-hydroxytetrahydrobiopterin (Q24063330), 4a-hydroxy-L-erythro-5,6,7,8-tetrahydrobiopterin (Q74417390)
- HMDB0002287: L-homocysteine thiolactone (Q27127188), DL-homocysteine thiolactone (Q27276123)
- HMDB0002294: (4Z,7R,8E,10Z,12E,14E,17S,19Z)-7,16,17-trihydroxydocosa-4,8,10,12,14,19-hexaenoic acid (Q27088536), resolvin D2 (Q60998704)
- HMDB0002299: (R)-3-aminoisobutyric acid (Q27101849), (R)-3-aminoisobutyric acid zwitterion (Q106345514)
- HMDB0002322: cadaverine (Q161555), cadaverine dihydrochloride (Q27133386)
- HMDB0002353: crocetin diglucopyranoside (Q27132162), (2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl (3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl (2E,4E,6E,8E,10E,12E,14E)-2,6,11,15-tetramethylhexadeca-2,4,6,8,10,12,14-heptaenedioate (Q104392176)
- HMDB0002366: O-tiglylcarnitine (Q27139422), O-tiglyl-L-carnitine (Q27158616)
- HMDB0002374: (17R/S)-avenasterol (Q15410253), isofucosterol (Q27288596)
- HMDB0002388: boswellic acid (Q45816), β-boswellic acid (Q27274271)
- HMDB0002541: D-galactono-1,4-lactone (Q27098286), Galactonolactone (Q83049468)
- HMDB0002666: thiamine phosphoric acid ester (Q27094344), thiamine monophosphate (Q60998707)
- HMDB0002741: fucoxanthin (Q96385), all-trans-Fucoxanthin (Q104392152)
- HMDB0002786: nitrous acid (Q211891), nitrite ion (Q213788), nitrite (Q72157355)
- HMDB0002869: campesterol (Q2756479), 24-epicampesterol (Q27109255)
- HMDB0002923: beta-isomaltose (Q2409080), isomaltose (Q28487684)
- HMDB0002972: vitamin K epoxide (Q27103659), (E,2S,3R)-phytonadione epoxide (Q27287062)
- HMDB0003011: O-acetylserine (Q309897), O-acetyl-L-serine zwitterion (Q106345618)
- HMDB0003069: 20β-hydroxyprogesterone (Q4630845), 20α-hydroxyprogesterone (Q28529678)
- HMDB0003074: delphinidin chloride (Q367258), delphinidin(1+) (Q63409071)
- HMDB0003173: petunidin chloride (Q3137150), petunidin (Q27145212)
- HMDB0003178: heme (Q189621), heme B (Q620084), ferroheme b(2-) (Q27127201)
- HMDB0003218: withanolides (Q907017), Withanolide (Q120355450)
- HMDB0003219: beta- D- sedoheptulopyranose (Q27103174), D-manno-2-Heptulose (Q47459280)
- HMDB0003231: trans-vaccenic acid (Q419047), cis-vaccenic acid (Q27095533)
- HMDB0003263: pelargonidin (Q2522451), pelargonidin chloride (Q27103746)
- HMDB0003265: hesperidin (Q385937), Hesperidine (Q104398984)
- HMDB0003355: δ-aminovaleric acid (Q11751639), 5-aminopentanoic acid zwitterion (Q106315172)
- HMDB0003357: N(2)-acetyl-L-ornithine (Q26690116), N(2)-acetyl-L-ornithine zwitterion (Q106345492)
- HMDB0003362: chitin (Q161219), beta-D-GlcpNAc-(1->4)-beta-D-GlcpNAc-(1->4)-beta-D-GlcpNAc (Q27139583)
- HMDB0003363: pectic acid (Q2069698), α-D-galacturonic acid (Q27094449)
- HMDB0003375: (-)-limonene (Q27089405), (+)-limonene (Q27888324)
- HMDB0003379: triphosphoric acid (Q2823316), triphosphate(5-) (Q27102779)
- HMDB0003402: pectin (Q188154), β-D-Galactopyranuronic acid (Q27094571)
- HMDB0003406: D-Serine (Q27077119), D-serine zwitterion (Q106345496)
- HMDB0003411: D-proline (Q20035962), D-proline zwitterion (Q106345479)
- HMDB0003417: D-Cysteine (Q16633812), D-cysteine zwitterion (Q106345466)
- HMDB0003418: keto-D-tagatose (Q414089), beta-D-tagatopyranose (Q27121478)
- HMDB0003423: D-glutamine (Q27102193), D-glutamine zwitterion (Q106345528)
- HMDB0003459: D-alanyl-D-alanine (Q27101980), D-alanyl-D-alanine zwitterion (Q106345519)
- HMDB0003464: 4-guanidinobutyric acid (Q27457468), 4-guanidinobutanoic acid zwitterion (Q106345599)
- HMDB0003501: trans-caffeic acid (Q414116), cis-caffeic acid (Q27102378)
- HMDB0003572: rosmarinic acid (Q7762), (R)-rosmarinic acid (Q50380051)
- HMDB0003581: D-Dethiobiotin (Q27094671), dethiobiotin (Q27102028)
- HMDB0003584: taurocyamine (Q27077930), taurocyamine zwitterion (Q106345498)
- HMDB0003609: dehydroalanine (Q1183089), 2-ammonioprop-2-enoate (Q106314670)
- HMDB0003642: strontium (Q938), strontium cation (Q27104290)
- HMDB0003712: trans-dodec-2-enoyl-CoA(4-) (Q27124430), Coenzyme A, S-2-dodecenoate, (Z)- (Q115966126)
- HMDB0003831: 3-amino-3-(4-hydroxyphenyl)propanoic acid (Q27102141), 3-amino-3-(4-hydroxyphenyl)propanoic acid zwitterion (Q106345526)
- HMDB0003869: Epsilon-(gamma-Glutamyl)-lysine (Q27160374), epsilon-(gamma-glutamyl)lysine dizwitterion (Q106314671)
- HMDB0003937: 3-oxolauroyl-CoA (Q27103381), AG-H-14200 (Q82096617)
- HMDB0003938: (S)-3-hydroxydecanoyl-CoA (Q27103637), PUBCHEM_16061159 (Q82472806)
- HMDB0003939: 3-oxodecanoyl-CoA (Q27103757), 3-ketodecanoyl-CoA (Q82096621)
- HMDB0003941: 3-oxooctanoyl-CoA (Q27103595), 3-ketooctanoyl-CoA (Q82096622)
- HMDB0003966: DL-selenomethionine (Q415925), L-selenomethionine (Q27096144), L-selenomethionine zwitterion (Q106314672)
- HMDB0003974: oxalosuccinic acid (Q424172), (S)-oxalosuccinic acid (Q27120572)
- HMDB0003976: 1-phospho-alpha-D-glucuronic acid (Q27102077), D-glucuronic acid 1-phosphate (Q27116432)
- HMDB0003993: alpha carotene (stereochemistry specified) (Q142871), α/β-carotene (not stereospecified) (Q47459177)
- HMDB0004041: allo-L-threonine (Q27103859), L-allothreonine zwitterion (Q106314654)
- HMDB0004043: (R)-(+)-alpha-terpineol (Q27105290), alpha-terpineol (Q27109437)
- HMDB0004113: methylselenocysteine (Q21099600), Se-methyl-L-selenocysteine zwitterion (Q106345484)
- HMDB0004158: i-urobilinogen (Q57054), D-Urobilinogen (Q27106322)
- HMDB0004225: 5-guanidino-2-oxopentanoic acid (Q27103511), 5-guanidino-2-oxopentanoic acid zwitterion (Q106345552)
- HMDB0004231: DL-panthenol (Q196473), dexpanthenol (Q47495755)
- HMDB0004242: 11-dehydro-thromboxane B2 (Q2806929), (E)-7-[(2R,3S,4S)-4-hydroxy-2-[(E,3S)-3-hydroxyoct-1-enyl]-6-oxooxan-3-yl]hept-5-enoic acid (Q113957438)
- HMDB0004249: Phosphatidylinositol (3,4,5)-trisphosphate (Q3078767), PIP3 (Q27088399)
- HMDB0004321: (-)-limonene (Q27089405), (+)-limonene (Q27888324)
- HMDB0004326: 2'-O-Methyladenosine (Q15632794), 2-O-methyladenosine (Q105105422)
- HMDB0004350: anabasine (Q419308), 3-(piperidin-2-yl)pyridine (Q97463797)
- HMDB0004472: eucalyptol (Q161572), 1,8-cineole (Q105302939)
- HMDB0004682: 11(R)-HETE (Q27104279), (5E,8Z,11R,12Z,14Z)-11-hydroxyicosa-5,8,12,14-tetraenoic acid (Q113949465)
- HMDB0004705: 12,13-DiHOME (Q27140059), (9Z,12S,13S)-12,13-dihydroxyoctadec-9-enoic acid (Q104968221)
- HMDB0004808: phylloquinone aglycone I (Q27161681), 7C-Aglycone (Q106045287)
- HMDB0004826: oxedrine (Q421351), (-)-oxedrine (Q27105248)
- HMDB0004866: Lactosylceramide (d18:1/12:0) (Q27161642), N-(dodecanoyl)-1-beta-lactosyl-sphing-4-enine (Q120326695)
- HMDB0005010: sertraline (Q407617), sertraline hydrochloride (Q27108281)
- HMDB0005065: O-oleoylcarnitine (Q27104999), oleoyllevocarnitine (Q27157965)
- HMDB0005084: N-Acetylleukotriene E4 (Q27107458), (5R,6S,7E,9E,11Z,14Z)-6-{[(2S)-2-carboxy-2-acetamidoethyl]sulfanyl}-5-hydroxyicosa-7,9,11,14-tetraenoic acid (Q120205464)
- HMDB0005382: 1,2-dioleoyl-3-palmitoyl-sn-glycerol (Q27145410), 1,2-dioleoyl-3-palmitoylglycerol (Q27145595)
- HMDB0005403: 1,2-dioleoyl-3-stearoyl-sn-glycerol (Q27147271), 1-octadecanoyl-2,3-dioleoyl-sn-glycerol (Q27162164)
- HMDB0005783: gingerol (Q421081), 5-Hydroxy-1-(4-hydroxy-3-methoxyphenyl)decan-3-one (Q72484395)
- HMDB0005831: D-glucitol 6-phosphate (Q27102187), (2,3,4,5,6-pentahydroxyhexyl)oxyphosphonic acid (Q110204271)
- HMDB0006029: N(2)-acetylglutamine (Q4673064), N-Acetyl-L-glutamine (Q63390525)
- HMDB0006088: scyllo-inositol (Q3023527), epi-inositol (Q3589114)
- HMDB0006111: 12S-HETE (Q2823198), 12-HETE (Q27109114)
- HMDB0006240: edaravone (Q335099), 5-Methyl-2-phenyl-1,2-dihydropyrazol-3-one (Q72494780)
- HMDB0006245: 18-HETE (Q27070791), 18(R)-HETE (Q27163071)
- HMDB0006246: (9Z,12Z,15Z,18Z)-tetracosatetraenoate (Q27146814), (9Z,12Z,15Z,18Z)-tetracosatetraenoic acid (Q27147127)
- HMDB0006272: 5-amino-2-oxopentanoic acid (Q27121579), 5-amino-2-oxopentanoic acid zwitterion (Q106345575)
- HMDB0006283: 20α-hydroxycholesterol (Q27067423), (3BETA,20R)-CHOLEST-5-ENE-3,20-DIOL (Q27095447)
- HMDB0006330: D-mannose 1-phosphate (Q258734), alpha-D-mannose 1-phosphate (Q27102901)
- HMDB0006334: 3-dehydro-L-gulonic acid (Q27098398), 3-dehydro-L-gulonate (Q27124840)
- HMDB0006343: L-selenocystathionine (Q27103310), L-selenocystathionine zwitterion (Q106345551)
- HMDB0006406: ecgonine methyl ester (Q27095434), ecgonine methyl ester (incomplete stereo) (Q55167836)
- HMDB0006454: (S)-2-amino-3-ketobutyric acid (Q27094776), L-2-amino-3-oxobutanoic acid zwitterion (Q106345508)
- HMDB0006460: (R)-icosanoylcarnitine (Q27157961), O-icosanoylcarnitine (Q106009789)
- HMDB0006471: (2S,3R)-3-hydroxybutane-1,2,3-tricarboxylic acid (Q27098140), 3-Carboxy-2,3-dideoxy-4-C-methylpentaric acid (Q82960805)
- HMDB0006498: 3-oxooctadecanoyl-CoA (Q27122119), 3-Ketostearoyl-coenzyme A (Q115965879)
- HMDB0006566: Lacto-N-tetraose (Q27104118), beta-D-Galp-(1->3)-beta-D-GlcpNAc-(1->3)-beta-D-Galp-(1->4)-beta-D-Glcp (Q27124068)
- HMDB0006567: beta-D-Gal-(1->4)-beta-D-GlcNAc-(1->3)-beta-D-Gal-(1->4)-D-Glc (Q27127149), beta-D-Galp-(1->4)-beta-D-GlcNAcp-(1->3)-beta-D-Galp-(1->4)-beta-D-Glcp (Q27131445)
- HMDB0006591: lactosamine (Q27109860), (2R,3R,4S,5R)-2-amino-3,5,6-trihydroxy-4-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyhexanal (Q76010093)
- HMDB0006620: 3'-fucosyllactose (Q617126), (2R,3S,4S,5S,6R)-2-[(2S,3S,4S,5R,6R)-3,5-dihydroxy-2-methoxy-6-[[(2R,3S,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxymethyl]oxan-4-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol (Q76512120)
- HMDB0006698: beta-D-GlcpNAc-(1->4)-beta-D-GlcpNAc-(1->4)-beta-D-GlcpNAc (Q27139583), N-[(2S,3R,4R,5S,6R)-2-[(2R,3S,4R,5R,6S)-5-acetamido-6-[(2R,3S,4R,5R)-5-acetamido-1,2,4-trihydroxy-6-oxohexan-3-yl]oxy-4-hydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide (Q76010395)
- HMDB0006792: epimelibiose (Q27106486), Gal(a1-6)a-Man (Q104984606)
- HMDB0006840: 4,4-dimethyl-5alpha-cholest-8-en-3beta-ol (Q27105117), 4,4-Dimethylcholest-8(9)-en-3beta-ol (Q110171340)
- HMDB0006875: 1-pyrroline-2-carboxylic acid (Q27093798), 1-pyrroline-2-carboxylic acid zwitterion (Q106345505)
- HMDB0006938: 2-hydroxy-3-oxopropanoic acid (Q15732146), (S)-2-hydroxy-3-oxopropanoic acid (Q106687202)
- HMDB0007854: 1-stearoyl-sn-glycero-3-phosphate (Q27144960), 2-Hydroxy-3-(phosphonooxy)propyl octadecanoate (Q82921844)
- HMDB0007855: lysophosphatidic acid (Q2823281), 1-oleoyl-sn-glycerol 3-phosphate (Q27132220)
- HMDB0010212: 17(18)-EpETE (Q27140189), 17(R),18(S)-EETeTr (Q27146469)
- HMDB0010216: 5,15-DiHETE (Q27140198), 5(S),15(S)-DiHETE (Q27163191)
- HMDB0010244: 1,1',2-trilinoleoyl-2'-palmitoyl cardiolipin (Q27157732), 1'-[1-(9Z,12Z-octadecadienoyl)-2-hexadecanoyl-sn-glycero-3-phospho],3'-[1,2-di-(9Z,12Z-octadecadienoyl)-sn-glycero-3-phospho]-sn-glycerol (Q120323000)
- HMDB0010247: 1,1',2-trilinoleoyl-2'-oleoyl cardiolipin (Q27157731), 1'-[1-(9Z,12Z-octadecadienoyl)-2-(9Z-octadecenoyl)-sn-glycero-3-phospho],3'-[1,2-di-(9Z,12Z-octadecadienoyl)-sn-glycero-3-phospho]-sn-glycerol (Q120323109)
- HMDB0010572: 1-Hexadecanoyl-2-octadecanoyl-sn-glycero-3-phospho-(1'-sn-glycerol) (Q27140391), 1-Hexadecanoyl-2-octadecanoyl-sn-glycero-3-phosphate (Q27140403)
- HMDB0010574: 1-palmitoyl-2-oleoyl-sn-glycero-3-(phospho-rac-(1-glycerol)) (Q27115796), (1r)-2-{[(S)-{[(2s)-2,3-Dihydroxypropyl]oxy}(Hydroxy)phosphoryl]oxy}-1-[(Hexadecanoyloxy)methyl]ethyl (9z)-Octadec-9-Enoate (Q106030417)
- HMDB0010698: N-hexadecanoylsphingosine 1-phosphate (Q27140346), [(2S,3R)-2-(hexadecanoylamino)-3-hydroxyoctadecyl] dihydrogen phosphate (Q76294326)
- HMDB0011119: selenious acid (Q413722), selenite ion (Q27102911)
- HMDB0011131: glycerol monostearate (Q5572563), 1-stearoyl-sn-glycerol (Q27145388)
- HMDB0011140: hypusine (Q2067805), (2S)-2-amino-6-{[(2S)-4-amino-2-hydroxybutyl]amino}hexanoic acid (Q120199023)
- HMDB0011143: batilol (Q27115823), 1-O-octadecyl-sn-glycerol (Q74418383)
- HMDB0011602: 3-oxoalanine (Q27102573), D-3-oxo-alanine (Q101096468)
- HMDB0011616: 2',3'-cyclic AMP (Q27103372), Adenosine 2',3'-cyclic phosphate (Q115972209)
- HMDB0011620: arsenous acid (Q423271), ortho-arsenite ion (Q26841209)
- HMDB0011625: cacodylic acid (Q420680), dimethylarsinate ion (Q27098592)
- HMDB0011627: S-[(2E,6E)-farnesyl]-L-cysteine (Q27131636), S-[(2E,6E)-farnesyl]-L-cysteine zwitterion (Q106314675)
- HMDB0011628: enoxolone (Q5948038), Biosone (Q110184372)
- HMDB0011631: 3-hydroxy-L-kynurenine (Q27102345), 3-hydroxy-L-kynurenine zwitterion (Q106345536)
- HMDB0011655: 2-(3-amino-3-carboxypropyl)-L-histidine (Q27102235), 2-(3-amino-3-carboxypropyl)-L-histidine dizwitterion (Q106345529)
- HMDB0011690: 7-deaza-7-aminomethyl-guanine (Q27094231), 7-aminomethyl-7-deazaguanine (Q27120591)
- HMDB0011694: SM(d16:1/24:1(15Z)) (Q27161419), [(E,2S,3R)-3-hydroxy-2-[[(Z)-tetracos-15-enoyl]amino]hexadec-4-enyl] 2-(trimethylazaniumyl)ethyl phosphate (Q113949295)
- HMDB0011733: diglycine (Q665455), glycylglycine zwitterion (Q106345680)
- HMDB0011747: 2-aminoethylphosphonic acid (Q421682), (2-aminoethyl)phosphonic acid zwitterion (Q106345658)
- HMDB0011756: acetylleucine (Q2823840), L-Acetylleucine (Q63395724)
- HMDB0012127: L-BENZYLSUCCINIC ACID (Q27096725), (S)-2-Benzylsuccinic acid (Q72442989)
- HMDB0012131: (5S)-5-amino-3-oxohexanoic acid (Q27103276), (5S)-5-amino-3-oxohexanoic acid zwitterion (Q106345550)
- HMDB0012151: 6-amino-2-oxohexanoic acid (Q27102446), 6-amino-2-oxohexanoic acid zwitterion (Q106345540)
- HMDB0012202: 9-(alpha-D-glucosyl)-cis-zeatin (Q27140011), 9-(beta-D-glucosyl)-cis-zeatin (Q63395524)
- HMDB0012204: cis-zeatin (Q22807315), trans-zeatin (Q22807318)
- HMDB0012242: Ketoconazole (Q407883), (2S,4R)-ketoconazole (Q27120779)
- HMDB0012249: (2S)-2-azaniumyl-4-oxobutanoate (Q74417377), (2S)-2-amino-4-oxobutanoic acid (Q106371441)
- HMDB0012283: prephenic acid (Q2598317), prephenic acid (Q104999439)
- HMDB0012289: (S)-2,3,4,5-tetrahydrodipicolinic acid (Q27105375), 2,3,4,5-tetrahydrodipicolinic acid (Q27115166)
- HMDB0012453: 3beta-hydroxycholest-5-en-26-oic acid (Q27154973), (25R)-3beta-hydroxycholest-5-en-26-oic acid (Q27159118)
- HMDB0012467: (-)-Epicatechin sulfate (Q27160344), (3R)-2-(3,4-Dihydroxyphenyl)-6-hydroxy-3-sulfooxy-3,4-dihydro-2H-chromen-8-olate (Q101432282)
- HMDB0012563: 13,14-dihydrolipoxin A4 (Q27148267), (5R,6R,7E,9E,11Z,15R)-5,6,15-trihydroxyicosa-7,9,11-trienoic acid (Q76727497)
- HMDB0012575: Delta(13)-16-carboxy-tetranor-LTE4 (Q27144370), (3E,5Z,7E,9E,11R,12S)-11-[(2S)-2-amino-2-carboxyethyl]sulfanyl-12-hydroxyhexadeca-3,5,7,9-tetraenedioic acid (Q76727501)
- HMDB0012607: 18-carboxy-19,20-dinor-leukotriene E4 (Q27144335), (4Z,7Z,9E,11E,13R,14S)-13-[(2S)-2-amino-2-carboxyethyl]sulfanyl-14-hydroxyoctadeca-4,7,9,11-tetraenedioic acid (Q59342393)
- HMDB0012611: 18R-HEPE (Q27070792), (5Z,8Z,11E,14Z,16E,18S)-18-hydroxyicosa-5,8,11,14,16-pentaenoic acid (Q113947728)
- HMDB0012715: 3-hydroxyoctadecanoyl-CoA (Q27122129), 3-Hydroxyoctadecanoyl-coenzyme A (Q115966162)
- HMDB0013043: prostaglandin E2 1-glyceryl ester (Q27162412), 1-Glyceryl-PGE2 (Q106039048)
- HMDB0013126: (R)-crotonylcarnitine (Q27105105), Butenylcarnitine (Q27160747)
- HMDB0013222: 3-guanidinopropionic acid (Q5613765), 3-guanidinopropanoic acid zwitterion (Q106345675)
- HMDB0013244: Lipid A (Q3077338), Marinomonas communis lipid A (Q27120766)
- HMDB0013318: tryptophanamide (Q27095301), TRYPTOPHAN AMIDE (Q82855367)
- HMDB0013609: D-Tryptophan (Q27077125), D-tryptophan zwitterion (Q106345497)
- HMDB0013656: 15-deoxy-Delta(12,14)-prostaglandin J2-2-glyceryl ester (Q27105109), 1,3-dihydroxypropan-2-yl (Z)-7-[(1S,5E)-5-[(Z)-oct-2-enylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoate (Q76727964)
- HMDB0013687: (+)-nootkatone (Q417896), nootkatone (Q104667203)
- HMDB0013809: (2E)-2-octenal (Q2448755), oct-2-enal (Q27131344)
- HMDB0013821: diisobutyl ketone (Q2416556), 4-Heptanone, 2-methyl- (Q81989198)
- HMDB0013825: 4-(1,1,3,3-Tetramethylbutyl)phenol (Q15632771), p-tert-pentylphenol (Q26840951)
- HMDB0013940: 3-hydroxyhexobarbital (Q27105470), 6-Hydroxy-5-(3-hydroxycyclohex-1-en-1-yl)-3,5-dimethylpyrimidine-2,4(3H,5H)-dione (Q82944342)
- HMDB0014262: octreotide (Q419935), (4R,7S,10S,13R,16S,19R)-10-(4-aminobutyl)-16-benzyl-N-[(2R,3R)-1,3-dihydroxy-2-butanyl]-7-(1-hydroxyethyl)-13-(1H-indol-3-ylmethyl)-6,9,12,15,18-pentaoxo-19-(D-phenylalanylamino)-1,2-dithia-5,8,11,14,17-pentaazacycloicosane-4-carboxamide (Q63413189)
- HMDB0014371: guanadrel (Q5613557), guanadrel sulfate (Q27106807)
- HMDB0014384: oxiconazole (Q3359058), oxiconazole nitrate (Q27107595)
- HMDB0014400: diethylstilbestrol (Q423989), 4-[4-(4-hydroxyphenyl)hex-3-en-3-yl]phenol (Q27164556)
- HMDB0014401: chlortetracycline (Q417948), lymecycline (Q113959621)
- HMDB0014429: acarbose (Q338005), acarbose (Q105342260)
- HMDB0014480: nitrofurazone (Q425502), (2E)-2-[(5-nitro-2-furanyl)methylene]hydrazinecarboxamide (Q103964761)
- HMDB0014521: (3aS)-palonosetron (Q419841), (3aR)-Palonosetron (Q61815178)
- HMDB0014550: crystal violet (Q420705), Gentian violet cation (Q63390508)
- HMDB0014587: teniposide (Q417555), teniposide (Q113959624)
- HMDB0014608: ketorolac (Q2014797), ketorolac tromethamine (Q27107089)
- HMDB0014733: oxytetracycline (Q411646), (4S,4aR,5S,5aR,6S,12aS)-4-(dimethylamino)-3,5,6,10,11,12a-hexahydroxy-6-methyl-1,12-dioxo-4,4a,5,5a-tetrahydrotetracene-2-carboxamide (Q115972136)
- HMDB0014766: clorazepic acid (Q418850), clorazepate (Q27126795)
- HMDB0014841: methazolamide (Q1149099), (Z)-methazolamide (Q27276292)
- HMDB0014873: naftifine (Q413586), N-methyl-N-(1-naphthalenylmethyl)-3-phenyl-2-propen-1-amine (Q27165018)
- HMDB0014997: D-penicillamine (Q421239), (±)-penicillamine (Q27122242)
- HMDB0015021: isosorbide dinitrate (Q179748), nitrate ion (Q182168)
- HMDB0015070: oxymetazoline (Q417813), oxymetazoline hydrochloride (Q27107602)
- HMDB0015106: selenium disulfide (Q419375), selenium sulfide (Q27430357)
- HMDB0015188: mimosine (Q3180669), L-mimosine zwitterion (Q106345625)
- HMDB0015206: fludarabine phosphate (Q185916), fludarabine (Q72478349)
- HMDB0015210: etidronic acid (Q2758338), etidronate disodium (Q27106537)
- HMDB0015230: rosuvastatin (Q415159), rosuvastatin calcium (Q27146836)
- HMDB0015281: (E)-cefprozil (Q3231623), (EZ)-cefprozil (Q72516593)
- HMDB0015322: (RS)-fenfluramine (Q418928), dexfenfluramine (Q3025599)
- HMDB0015362: saquinavir (Q422654), Saquinavir (Q69757828)
- HMDB0015383: ergometrine (Q424508), ergonovine maleate (Q27114403)
- HMDB0015386: retapamulin (Q7316645), {(1S,2R,3S,4S,6R,7R,8R,14R)-4-ethenyl-3-hydroxy-2,4,7,14-tetramethyl-9-oxo-6-tricyclo[5.4.3.01,8]tetradecanyl} 2-({(1R,5S)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl}sulfanyl)acetate (Q76393594)
- HMDB0015398: varenicline (Q411330), varenicline (Q114826146)
- HMDB0015466: (S)-(−)-colchicine (Q326224), (+/-)-Colchicine (Q26998324)
- HMDB0015531: iron (Q677), iron(III) (Q3233795)
- HMDB0015608: indacaterol (Q425654), indacaterol maleate (Q27137018)
- HMDB0015641: dabigatran etexilate (Q20078502), dabigatran etexilate mesylate (Q27139056)
- HMDB0028685: alanyl glutamine (Q27144111), Ala-Gln zwitterion (Q106314655)
- HMDB0028757: alpha-Asp-Leu (Q27137034), alpha-Aspartylleucine (Q82074302)
- HMDB0028816: Glutamyl-Cysteine (Q27161894), Glutamylcysteine (Q76415214)
- HMDB0028847: glycylmethionine (Q27144432), DL-glycylmethionine (Q27293942)
- HMDB0028848: Gly-Phe (Q27144236), glycyl-DL-phenylalanine (Q106026433)
- HMDB0028850: Gly-Ser (Q27140598), N-(2-Amino-1-hydroxyethylidene)serine (Q82976906)
- HMDB0028851: Gly-Thr (Q27144243), N-(2-Amino-1-hydroxyethylidene)threonine (Q82927866)
- HMDB0028902: Ile-Asn (Q27144376), Ile-Asn (Q82206550)
- HMDB0028910: Ile-Ile (Q27144380), ILE-ILE (Q82855565)
- HMDB0028929: Leu-Gly (Q27144713), N-(2-Amino-1-hydroxy-4-methylpentylidene)glycine (Q82962123)
- HMDB0028938: Leu-Ser (Q27140605), ST51015033 (Q82193732)
- HMDB0028940: Leu-Trp (Q27141904), N-(2-Amino-1-hydroxy-4-methylpentylidene)tryptophan (Q82948209)
- HMDB0028941: Leu-Tyr (Q27141905), LEU-TYR (Q82855955)
- HMDB0028942: Leu-Val (Q27141751), N-(2-Amino-1-hydroxy-4-methylpentylidene)valine (Q82904011)
- HMDB0028966: Met-Ala (Q27141919), methionylalanine (Q82449854)
- HMDB0028977: Met-Leu (Q27144843), Met-Leu (Q82190542)
- HMDB0028979: Met-Met (Q27144845), Methionine, methionyl- (Q82864731)
- HMDB0028985: Met-Tyr (Q27141932), MET-TYR (Q82855812)
- HMDB0029010: Pro-Ala (Q27144880), N-[Hydroxy(pyrrolidin-2-yl)methylidene]alanine (Q82969581)
- HMDB0029013: Pro-Asp (Q27144883), Pro-Asp (Q82198226)
- HMDB0029076: Trp-Ala (Q27144060), TRP-ALA (Q82855757)
- HMDB0029082: Trp-Glu (Q27144978), H-Trp-Glu-OH (Q82193946)
- HMDB0029087: Trp-Leu (Q27144982), TRP-LEU (Q82856232)
- HMDB0029090: Trp-Phe (Q27144985), TRP-PHE (Q82856576)
- HMDB0029095: Trp-Tyr (Q27144988), TRP-TYR (Q82856577)
- HMDB0029096: Trp-Val (Q27144987), Tryptophylvaline (Q82496254)
- HMDB0029104: Tyr-Glu (Q27144992), Tyrosylglutamic acid (Q82496253)
- HMDB0029109: Tyr-Leu (Q27145059), TYR-LEU (Q82855957)
- HMDB0029112: Tyr-Phe (Q27145062), Tyr-Phe (Q82190486)
- HMDB0029118: Tyr-Val (Q27145064), Tyrosylvaline (Q82448319)
- HMDB0029131: Val-Leu (Q27145072), valyllysine (Q27145073)
- HMDB0029156: gamma-Glu-Phe (Q27156504), (4S)-4-amino-5-[[(1S)-1-carboxy-2-phenylethyl]amino]-5-oxopentanoic acid (Q76511780)
- HMDB0029168: (S)-3-Aminohexanoic acid (Q72437573), 3-Aminohexanoic acid (Q72437580)
- HMDB0029196: α-D-fucopyranose (Q27094421), D-fucopyranose (Q27105572)
- HMDB0029199: trans-fertaric acid (Q5445562), fertaric acid (Q110184319)
- HMDB0029212: querciturone (Q6871627), miquelianin (Q104252968)
- HMDB0029222: Urolithin A-3-O-glucuronide (Q27161277), Urolithin A-3-O-glucuronide (Q115947948)
- HMDB0029225: p-coutaric acid (Q27146968), 4-[(2R)-2-(Aminomethyl)-2-(hydroxymethyl)-5-oxopyrrolidin-1-YL]-3-[(1-ethylpropyl)amino]benzoic acid (Q27461356)
- HMDB0029310: disogluside (Q27144338), Collettiside I (Q105314746)
- HMDB0029406: amaranthin (Q27105741), 5-({3-[(6-carboxy-3,4,5-trihydroxyoxan-2-yl)oxy]-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl}oxy)-1-[2-(2,6-dicarboxy-2,3-dihydro-1H-pyridin-4-ylidene)ethylidene]-6-hydroxy-2,3-dihydro-1H-1λ⁵-indol-1-ylium-2-carboxylate (Q110079096)
- HMDB0029415: L-carbocysteine (Q423408), DL-carbocysteine (Q27258488)
- HMDB0029430: L-methionine-S,R-sulfoximine (Q27103738), methionine sulfoximine (Q27120816)
- HMDB0029477: isomangiferin (Q27151338), 1,3,6,7-tetrahydroxy-4-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]xanthen-9-one (Q104955329)
- HMDB0029484: isovitexin 2''-O-beta-D-glucoside (Q27102344), Glucoisovitexin (Q105243594)
- HMDB0029493: formononetin 7-O-glucoside-6''-O-malonate (Q27149411), Formononetin 7-(6''-malonylglucoside) (Q105234434)
- HMDB0029500: kaempferol 3-O-glucuronide (Q27145499), Kaempferol-3-O-glucuronoside (Q104998505)
- HMDB0029523: neohesperidose (Q3347120), Neohesperidose (Q82215014)
- HMDB0029529: malonylgenistin (Q27149379), 6''-Malonylgenistin (Q104389696)
- HMDB0029565: demethoxyfumitremorgin C (Q27140133), 12-(2-Methylprop-1-enyl)-10,13,19-triazapentacyclo[11.7.0.03,11.04,9.015,19]icosa-3(11),4,6,8-tetraene-14,20-dione (Q104171226)
- HMDB0029710: DIMBOA glucoside (Q27101992), 4-hydroxy-7-methoxy-2-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2H-1,4-benzoxazin-3-one (Q105312533)
- HMDB0029804: Momordol (Q6897454), momordol (Q105026223)
- HMDB0029843: glycyrrhizin (Q418705), liquorice (Q105155240)
- HMDB0029915: (+)-ononitol (Q7094499), 1D-6-O-methyl-myo-inositol (Q27103880)
- HMDB0029937: panose (Q3362418), 2-(hydroxymethyl)-6-[(3,4,5-trihydroxy-6-{[4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy}oxan-2-yl)methoxy]oxane-3,4,5-triol (Q105201947)
- HMDB0029956: nebularine (Q3874106), nebularine (Q105170978)
- HMDB0029978: (S)-avenoleic acid (Q54857757), 15-hydroxylinoleic acid (Q112805971)
- HMDB0030128: physalin B (Q27137361), physalin B (Q105034425)
- HMDB0030151: β-sitosteryl acetate (Q27137775), Stigmast-5-en-3-yl acetate (Q105205497)
- HMDB0030211: laudanidine (Q27145755), laudanine (Q27893877)
- HMDB0030243: glucobrassicin (Q906037), Glucobrassicin (Q104253435)
- HMDB0030272: carpaine (Q3179543), carpaine (Q104914908)
- HMDB0030282: cinchonidine (Q412713), cinchonidine (Q104170423)
- HMDB0030305: dioscorine (Q19903961), dioscorine (Q105345998)
- HMDB0030346: actinidine (Q343309), 4,7-dimethyl-5H,6H,7H-cyclopenta[c]pyridine (Q105375954)
- HMDB0030348: (-)-annonaine (Q15410275), 1,2-Methylenedioxynoraporphine (Q105299983)
- HMDB0030388: zeatin riboside (Q27139815), 9-(beta-D-Ribofuranosyl)zeatin (Q106041543)
- HMDB0030463: Hyperforin (Q412742), 4-Hydroxy-8-methyl-3,5,7-tris(3-methylbut-2-enyl)-8-(4-methylpent-3-enyl)-1-(2-methylpropanoyl)bicyclo[3.3.1]non-3-ene-2,9-dione (Q105140966)
- HMDB0030520: virginiamycin group (Q3560696), N-{3-benzyl-12-ethyl-14,21-dihydroxy-4,16-dimethyl-2,5,11,18,24-pentaoxo-19-phenyl-17-oxa-1,4,10,13,20-pentaazatricyclo[20.4.0.0⁶,¹⁰]hexacosa-13,20-dien-15-yl}-3-hydroxypyridine-2-carboximidic acid (Q105104975)
- HMDB0030553: tricin 7-O-glucoside (Q27145235), Glucotricin (Q105127764)
- HMDB0030569: swertiajaponin (Q27108362), Leucanthoside (Q104984739)
- HMDB0030583: silibinin A (Q425702), Silymarin (Q27216069)
- HMDB0030590: dihydrosterigmatocystin (Q27140070), 5-Hydroxydihydrosterigmatocystin (Q104196588)
- HMDB0030591: 8-O-methyldihydrosterigmatocystin (Q27140071), 1,2-Dihydro-O-methylsterigmatocystin (Q104200579)
- HMDB0030614: orientin (Q421676), orientin (Q104194955)
- HMDB0030651: (±)-byakangelicin (Q104145631), (Rac)-Byakangelicin (Q105210588)
- HMDB0030658: carmine (Q320617), carminic acid (Q416860)
- HMDB0030682: cubebin (Q27134167), 3,4-bis(2H-1,3-benzodioxol-5-ylmethyl)oxolan-2-ol (Q104981852)
- HMDB0030684: cyanidin 3-glucoside chloride (Q5114535), cyanidin 3-O-β-D-glucoside (Q63399306)
- HMDB0030727: betagarin (Q27103260), Phytoalexin (Q77508412)
- HMDB0030747: hesperetin 7-O-beta-D-glucoside (Q23055243), hesperetin 7-O-glucoside (Q104909771)
- HMDB0030748: neohesperidin (Q18609455), Neohesperidin (Q104917305)
- HMDB0030753: aflatoxin Q1 (Q26998366), 14-hydroxy-11-methoxy-6,8,19-trioxapentacyclo[10.7.0.0²,⁹.0³,⁷.0¹³,¹⁷]nonadeca-1,4,9,11,13(17)-pentaene-16,18-dione (Q105023953)
- HMDB0030803: 5,7-Dihydroxy-2-(4-hydroxyphenyl)-8-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-6-(3,4,5-trihydroxyoxan-2-yl)chromen-4-one (Q104193816), corymboside (Q104392712)
- HMDB0030823: afzelechin (Q23068576), 3,5,7,4'-tetrahydroxyflavan (Q105244978)
- HMDB0030837: anethole (Q255564), (Z)-anethole (Q27147814)
- HMDB0030843: apiin (Q2858300), Apioside (Q105185392)
- HMDB0030851: aspalathin (Q2866762), aspalathin (Q104388865)
- HMDB0030860: avicularin (Q9163056), 3-[(2S,3R,4R,5S)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-2-(3,4-dihydroxyphenyl)-5,7-dihydroxychromen-4-one (Q104923824)
- HMDB0030884: Rutarin (Q27104967), 2-(2-hydroxypropan-2-yl)-9-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2H,3H-furo[3,2-g]chromen-7-one (Q105136414)
- HMDB0030885: 1,24-tetracosanediol (Q90549938), tetracosane-1,24-diol (Q120208812)
- HMDB0030961: oct-2-enal (Q27131344), (2Z)-2-octenal (Q27259912)
- HMDB0030963: punicic acid (Q201502), (E,Z,E)-octadeca-9,11,13-trienoic acid (Q27117716)
- HMDB0031020: (2E)-2-dodecenal (Q27252265), 2-dodecenal (Q81976703)
- HMDB0031021: acutoside A (Q27133812), 10-[4,5-Dihydroxy-6-(hydroxymethyl)-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid (Q104170876)
- HMDB0031057: (R)-2-hydroxypalmitic acid (Q27145666), (S)-2-hydroxypalmitic acid (Q27145669)
- HMDB0031211: endrin (Q423354), LSM-36947 (Q27216073)
- HMDB0031241: isopropyl acetate (Q419799), isovalerate (Q27121396)
- HMDB0031269: non-2-enal (Q27131346), (2Z)-2-nonenal (Q27274087)
- HMDB0031336: civetone (Q198354), (9E)-cycloheptadec-9-en-1-one (Q76416966)
- HMDB0031411: N(4)-acetyl-L-2,4-diaminobutyric acid (Q27107481), N(4)-acetyl-L-2,4-diaminobutyric acid zwitterion (Q106345569)
- HMDB0031434: bromine (Q879), dibromine (Q2685750)
- HMDB0031452: podofilox (Q421193), picropodophyllin (Q27088385)
- HMDB0031567: 3-methyl-4-phenyl-3-buten-2-one (Q72494711), (Z)-3-methyl-4-phenylbut-3-en-2-one (Q76304901)
- HMDB0031620: vestitone (Q23055339), vestitone (Q105310340)
- HMDB0031633: 3-O-methylcalopocarpin (Q27134919), 3-methoxy-2-(3-methylbut-2-enyl)-6a,11a-dihydro-6H-[1]benzofuro[3,2-c]chromen-9-ol (Q105004910)
- HMDB0031728: 2-hexylidenecyclopentanone (Q27279277), (2Z)-2-hexylidenecyclopentan-1-one (Q76323601)
- HMDB0031740: methyl dihydrojasmonate (Q3144605), trans-(-)-methyl dihydrojasmonate (Q27889465)
- HMDB0031814: Vitisin C (Q7937134), 4,4'-[(2-(4-Hydroxyphenyl)-2,3-dihydrobenzofuran-3,5-diyl)vinylene]bis(2-(4-hydroxyphenyl)-3-(3,5-dihydroxyphenyl)-6-hydroxy-2,3-dihydrobenzofuran) (Q104399934)
- HMDB0031846: geranylacetone (Q27135687), (E)-geranyl acetone (Q67879718)
- HMDB0031848: butylated hydroxyanisole (Q409401), 3-tert-butyl-4-hydroxyanisole (Q27145913)
- HMDB0032182: cadinene (Q414529), Amorphane (Q82004669)
- HMDB0032332: Hydroxylated lecithin (Q15411032), beta-L-aspartylhydroxamic acid (Q27123606), beta-L-aspartylhydroxamic acid zwitterion (Q106345578)
- HMDB0032386: docusate (Q27105309), 2-methylacetophenone (Q27253770)
- HMDB0032594: 6-methylsalicylic acid (Q6172528), 2-(hydroxymethyl)benzoic acid (Q27282279)
- HMDB0032734: (-)-3,4-dimethoxy-3,4-desmethylenedioxycubebin (Q27134168), 3',4'-Dimethoxy-3',4'-desmethylenecubebin (Q105286487)
- HMDB0032824: Yellow 2G (Q424528), Acid Yellow 17 (Q27272595)
- HMDB0033322: isosilybin (Q27149797), Isosilybin (Q103818912)
- HMDB0033325: silandrin (Q27108288), 2-Hydroxy-2,2-diphenylaceticacid (Q104968663)
- HMDB0033460: p-coumaroylagmatine (Q27104237), (E)-p-coumaroylagmatine (Q27158879)
- HMDB0033584: diethyl tartrate (Q886862), diethyl DL-tartrate (Q106339114)
- HMDB0033592: (+)-L-alliin (Q57741566), DL-alliin (Q57741744)
- HMDB0033669: phaseollidin (Q27102457), (6aR,11aR)-6a,11a-Dihydro-10-(3-methyl-2-buten-1-yl)-6H-benzofuro[3,2-c][1]benzopyran-3,9-diol; Phaseolidin (Q105191447)
- HMDB0033704: α-L-galactopyranose (Q27104500), L-galactopyranose (Q27117210)
- HMDB0033732: (+)-pisatin (Q17325709), pisatin (Q104252985)
- HMDB0033740: narirutin (Q13569061), Naringenin 7-rutinoside (Q105035142)
- HMDB0033779: piperic acid (Q1111585), isochavicinic acid (Q27257136)
- HMDB0033834: ethyl cinnamate (Q204182), (Z)-ethyl cinnamate (Q67866089)
- HMDB0033923: 2-amino-3-methylpentanoic acid (Q27117434), DL-isoleucine (Q60662693), D/L-alloisoleucine (Q110402556)
- HMDB0033987: ononin (Q7094502), ononin (Q104393076)
- HMDB0033990: sissotrin (Q23372518), Sissotrine (Q105150983)
- HMDB0034045: glucocleomin(1-) (Q27106753), Glucocleomin (Q104253438)
- HMDB0034058: cinquasia red (Q418071), Pigment Violet 19 (Q26706191)
- HMDB0034062: protodioscin (Q7251968), Furostane base-2H + O-Hex, O-Hex-dHex-dHex (Q105158057)
- HMDB0034070: sinigrin (Q65772506), Sinigrin (Q76393371)
- HMDB0034071: progoitrin (Q27288480), 2-Hydroxy-3-butenyl glucosinolate (Q104253326)
- HMDB0034092: physalin F (Q27137363), Physalin F (Q105292323)
- HMDB0034103: tomatine (Q288051), tomatin (unspec. stereochem.) (Q105234914)
- HMDB0034105: 3,6a,9-trihydroxypterocarpan (Q10910862), 6H-Benzofuro[3,2-c][1]benzopyran-3,6a,9(11aH)-triol, 9CI (Q105224237)
- HMDB0034184: licorisoflavan A (Q27137422), licorisoflavan A (Q104396555)
- HMDB0034188: glabridin (Q2386110), (R)-Glabridin (Q105149547)
- HMDB0034202: solanine (Q373791), α-solanine (Q105375470)
- HMDB0034219: 1D-5-O-methyl-chiro-inositol (Q27102872), D-pinitol (Q104987776)
- HMDB0034266: coprine (Q1131548), 2-Amino-5-[(1-hydroxycyclopropyl)amino]-5-oxopentanoic acid (Q115951975)
- HMDB0034322: 3-(5-oxoisoxazolin-2-yl)-L-alanine (Q27146380), 3-(5-Oxo-1,2-oxazol-2(5H)-yl)alanine (Q82925427)
- HMDB0034323: S-allylcysteine (Q7387047), DL-S-allylcysteine (Q105373939)
- HMDB0034340: physalin G (Q27137364), Physalin G (Q104958279)
- HMDB0034353: physalin D (Q27137362), Physalin D (Q104989217)
- HMDB0034360: Myricitrin (Q6948223), myricitrin (Q103818281)
- HMDB0034365: theanine (Q909931), N(5)-ethyl-L-glutamine zwitterion (Q106345693)
- HMDB0034403: barogenin (Q27159202), kryptogenin (Q105006755)
- HMDB0034451: ethyl oleate (Q6578680), 9-octadecenoic acid, ethyl ester (Q63409543)
- HMDB0034500: protobassic acid (Q27140292), 8,10,11-Trihydroxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid (Q105111468)
- HMDB0034502: arjunolic acid (Q27136879), 10,11-Dihydroxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid (Q104197007)
- HMDB0034504: sericoside (Q27288574), Sericoside (Q103817876)
- HMDB0034511: oleanolic aldehyde (Q27156391), 10-Hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carbaldehyde (Q105260265)
- HMDB0034525: theasapogenol b (Q27105918), AGN-PC-03DM82 (Q82095974)
- HMDB0034703: fumonisin B2 (Q5508613), 1,2,3-Propanetricarboxylicacid,1,1'-[(1S,2R)-1-[(2S,9R,11S,12S)-12-amino-9,11-dihydroxy-2-methyltridecyl]-2-[(1R)-1-methylpentyl]-1,2-ethanediyl]ester, (2R,2'R)- (Q104199027)
- HMDB0034745: ginsenoside Rf (Q27104950), Panaxoside RF (Q105282226)
- HMDB0034761: (5E)-5-nonen-2-one (Q27289074), 5-nonen-2-one (Q81993853)
- HMDB0034855: torososide B (Q27134801), 1-{[6-({[3,5-dihydroxy-6-(hydroxymethyl)-4-{[3,4,5-trihydroxy-6-({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)oxan-2-yl]oxy}oxan-2-yl]oxy}methyl)-3,4,5-trihydroxyoxan-2-yl]oxy}-8-hydroxy-3-methoxy-6-methylanthracene-9,10-dione (Q110196864)
- HMDB0034932: fenchol (Q417941), (-)-α-fenchyl alcohol (Q27089421)
- HMDB0034956: 15-hydroxysolavetivone (Q27158370), Oxysolavetivone (Q105133335)
- HMDB0034985: fenchone (Q414784), (1R,4S)-fenchone (Q27116898)
- HMDB0034995: ginsenoside Rc (Q27146714), JDCPEKQWFDWQLI-UHFFFAOYSA-N (Q105125365)
- HMDB0034996: ginsenoside C (Q27891169), NODILNFGTFIURN-UHFFFAOYSA-N (Q105182509)
- HMDB0034997: (+)-beta-selinene (Q27108640), (5xi,7xi,10xi)-eudesma-4(14),11-diene (Q27121582)
- HMDB0035030: (R)-amygdalin (Q410215), amygdalin (Q105342108)
- HMDB0035101: lansioside A (Q27135154), Lansiodide A (Q82095979)
- HMDB0035140: abscisic acid (Q332211), (S)-2-trans-abscisic acid (Q27109089)
- HMDB0035156: geranyl formate (Q15726045), neryl formate (Q104999727)
- HMDB0035219: aloin A (Q413888), aloin (Q27140379), aloin (Q104667246)
- HMDB0035282: solasodine (Q740439), solassodine (Q105147162)
- HMDB0035359: duvoglustat (Q15274561), 1-deoxynojirimycin (unspec. stereochemistry) (Q105158746)
- HMDB0035363: notoginsenoside R1 (Q27105065), ginsenoside R1 (Q105153640)
- HMDB0035395: ginsenoside Rg2 (Q27146707), 2-[2-[[3,12-dihydroxy-17-(2-hydroxy-6-methylhept-5-en-2-yl)-4,4,8,10,14-pentamethyl-2,3,5,6,7,9,11,12,13,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-6-yl]oxy]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-6-methyloxane-3,4,5-triol (Q104911681)
- HMDB0035409: ozone (Q36933), cyclic ozone (Q3359226)
- HMDB0035688: valencene (Q289496), valencene (Q105219112), 3-ispropenyl-4a,5-dimethyl-2,3,4,5,6,7-hexahydro-1H-naphthalene (Q107709810)
- HMDB0035742: absinthin (Q332313), Absinthin (van) (Q76856728)
- HMDB0035754: phytuberin (Q27107914), 2-{5,8-Dimethyl-2,6-dioxatricyclo[6.4.0.0^{1,5}]dodec-3-en-11-yl}propan-2-yl acetate (Q105345531)
- HMDB0035764: (+)-neoisomenthol (Q27109029), AC1LVZOS (Q82149170)
- HMDB0035765: p-menthan-3-ol (Q27109870), (±)-isomenthol (Q99693372), neomenthol (Q104625119)
- HMDB0035810: α-selinene (Q7448480), selinene (Q104194086)
- HMDB0035814: lactucin (Q6469057), 4-hydroxy-9-(hydroxymethyl)-6-methyl-3-methylidene-4,5,9a,9b-tetrahydro-3aH-azuleno[4,5-b]furan-2,7-dione (Q105287437)
- HMDB0035831: antheraxanthin (Q572404), 6-[(1E,3Z,5E,7E,9E,11Z,13E,15E,17E)-18-(4-hydroxy-2,6,6-trimethylcyclohexen-1-yl)-3,7,12,16-tetramethyloctadeca-1,3,5,7,9,11,13,15,17-nonaenyl]-1,5,5-trimethyl-7-oxabicyclo[4.1.0]heptan-3-ol (Q105191296)
- HMDB0035857: ginsenoside Rg1 (Q2276594), 2-[[3,12-dihydroxy-4,4,8,10,14-pentamethyl-17-[6-methyl-2-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyhept-5-en-2-yl]-2,3,5,6,7,9,11,12,13,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-6-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol (Q105364454)
- HMDB0035858: Obacunone (Q27107562), Tricoccin S3 (Q105160576)
- HMDB0035860: terretonin (Q27225281), Terretonin(RG) (Q103818168)
- HMDB0035906: alantolactone (Q21099633), alantolactone (Q105216305)
- HMDB0035913: (6E)-β-farnesene (Q27108631), (6Z)-β-farnesene (Q27119785)
- HMDB0035920: taraxasterol (Q27108380), Taraxasterin (Q105343603)
- HMDB0035934: isoalantolactone (Q27089356), 8a-Methyl-3,5-dimethylidene-3a,4,4a,6,7,8,9,9a-octahydrobenzo[f][1]benzofuran-2-one (Q104971015)
- HMDB0036052: Isomarasmone (Q77489212), Isomarasmone (Q104198937)
- HMDB0036065: (E,E)-α-farnesene (Q419814), (3E,6Z)-α-farnesene (Q27119783)
- HMDB0036083: carveol (Q2920205), (±)-trans-carveol (Q106512643), (±)-cis-carveol (Q106512647), cis-(+)-carveol (Q106512649)
- HMDB0036101: (-)-linalool (Q27105200), (+)-linalool (Q27105233)
- HMDB0036103: (2E)-geranic acid (Q4381113), 3,7-dimethylocta-2,6-dienoic acid (Q61738906)
- HMDB0036128: trans-(-)-pinocarveol (Q27156713), (1r,3s,5r)-6,6-Dimethyl-2-methylidenebicyclo[3.1.1]heptan-3-ol (Q105150076)
- HMDB0036156: deoxynivalenol (Q420518), Vomitoxin (Q105152303)
- HMDB0036444: delta-guaiene (Q27132629), Guaia-1(10),11-diene (Q105348323)
- HMDB0036458: 1-aminocyclopropanecarboxylic acid (Q409061), 1-aminocyclopropanecarboxylic acid zwitterion (Q106345635)
- HMDB0036562: aucubin (Q418014), Rhinanthin (Q105238073)
- HMDB0036600: T-2 mycotoxin (Q421570), T-2 toxin (Q110079869)
- HMDB0036629: (-)-maackiain (Q27105234), maackiain (Q27140245)
- HMDB0036687: Tanavulgarol (Q104224538), 1-{3-hydroxy-2,6-dimethylbicyclo[3.1.1]heptan-6-yl}-4-methylpent-3-en-2-one (Q105268510)
- HMDB0036692: heliangin (Q27089353), (9Z)-8-hydroxy-4,9-dimethyl-14-methylidene-13-oxo-5,12-dioxatricyclo[9.3.0.0⁴,⁶]tetradec-9-en-2-yl (2E)-2-methylbut-2-enoate (Q110185213)
- HMDB0036766: (Z)-furanogermenone (Q27155083), furanogermenone (Q104375853)
- HMDB0036786: lansic acid (Q27135951), 21,22-Bisseco-4(23),7,14(27),22(29)-onoceratetraene-3,21-dioic acid (Q105263791)
- HMDB0036797: mustakone (Q27134973), mustakone (Q104969766)
- HMDB0036827: sclareol (Q796619), sclareol (Q105343185)
- HMDB0036831: ambroxan (Q2793438), ambroxide (Q81976567)
- HMDB0036847: zizyberanalic acid (Q27136060), Zizyberanalic acid (Q105255699)
- HMDB0036888: quassimarin (Q27089373), Quassimarin (Q105004034)
- HMDB0036937: 1-caffeoyl-beta-D-glucose (Q27105318), 1-o-Caffeoylglucose (Q104393258)
- HMDB0036997: terpinene (Q424891), β-terpinene (Q23057921)
- HMDB0037185: rhodinyl formate (Q27272335), 7-Octen-1-ol, 3,7-dimethyl-, 1-formate (Q82854372)
- HMDB0037186: citronellyl acetate (Q27138814), 7-Octen-1-ol, 3,7-dimethyl-, 1-acetate (Q82854373)
- HMDB0037368: quercetin 3-O-β-D-(6''-O-malonyl)-glucoside (Q27114775), Quercetin 3-(6''-malonyl-glucoside) (Q105176924)
- HMDB0037408: neocarlinoside (Q27107512), 8-Arabinosyl-6-glucosylluteolin (Q104200813)
- HMDB0037419: maysin (Q27138546), Maysin (Q105010142)
- HMDB0037476: neocarthamin (Q27155208), 6,7-Dihydroxy-2-(4-hydroxyphenyl)-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3-dihydrochromen-4-one (Q105269276)
- HMDB0037487: poncirin (Q3388129), 7-[4,5-Dihydroxy-6-(hydroxymethyl)-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxy-5-hydroxy-2-(4-methoxyphenyl)-2,3-dihydrochromen-4-one (Q105181240)
- HMDB0037505: trilobatin (Q3539189), trilobatin (Q105017751)
- HMDB0037585: archangelenone (Q27135053), selinone (Q104400447)
- HMDB0037601: malonylapiin (Q27107294), 6''-Malonylapiin (Q110184535)
- HMDB0037784: alpha-muurolene (Q27133436), 1.Xi.,6.xi.,7.xi.-cadina-4,9-diene (Q82006251)
- HMDB0037790: ethylene glycol (Q194207), polyethylene glycol (Q410083)
- HMDB0037807: (9E)-9-undecenal (Q27291395), 9-undecenal (Q81976687)
- HMDB0037963: actinidic acid (Q27139629), CID 23132228 (Q104994572)
- HMDB0037976: cyanidin 3-O-beta-D-sambubioside (Q23465648), Sambicyanin (Q104388774)
- HMDB0038003: delphinidin 3-O-beta-D-sambubioside (Q27144921), Delphinidin 3-O-sambubioside (Q105266228)
- HMDB0038009: malvin (Q137532), Malvin (Q110204677)
- HMDB0038102: hispaglabridin a (Q27106874), (R)-Hispaglabridin A (Q105035684)
- HMDB0038120: Ovalicin (Q27095142), 4-hydroxy-5-methoxy-4-[2-methyl-3-(3-methylbut-2-en-1-yl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-one (Q110079166)
- HMDB0038155: beta-bourbonene (Q27160892), β-bourbonene (Q104667257)
- HMDB0038206: gamma-muurolene (Q27133437), gamma-Muurolene (Q105311286)
- HMDB0038207: (-)-γ-cadinene (Q27132466), (+)-γ-cadinene (Q27132468)
- HMDB0038352: lucidenic acid N (Q27135210), 4-(3,7-dihydroxy-4,4,10,13,14-pentamethyl-11,15-dioxo-2,3,5,6,7,12,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid (Q104201531)
- HMDB0038360: theasinensin A (Q27108424), theasinensin D (Q60794989)
- HMDB0038384: neoglucobrassicin (Q27103170), Neoglucobrassicin (Q76309363)
- HMDB0038403: glucoerucin(1-) (Q27106756), 4-Methylthiobutyl glucosinolate (Q105010330)
- HMDB0038417: glucobrassicanapin(1-) (Q27106750), 4-Pentenylglucosinolate (Q76403354)
- HMDB0038418: glucoconringiin(1-) (Q27106755), Glucoconringiin (Q104393355)
- HMDB0038419: glucotropeolin (Q27102224), [(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (1E)-2-phenyl-N-sulfooxyethanimidothioate (Q63399038)
- HMDB0038423: gluconasturtiin (Q412097), Gluconasturtiin (Q104392903)
- HMDB0038427: gluconapin(1-) (Q27106763), [(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (1E)-N-sulfooxypent-4-enimidothioate (Q63398656)
- HMDB0038581: 12,13-dihydroxyfumitremorgin C (Q27140131), Dihydroxyfumitremorgin C (Q103817921)
- HMDB0038848: apigenin 7-O-neohesperidoside (Q3429675), rhoifolin (Q104246960)
- HMDB0038850: cycasin (Q1097932), Methylazoxymethanol glucoside (Q104253320)
- HMDB0038922: (+)-lyoniresinol-3-alpha-O-beta-D-glucopyranoside (Q27135222), 2-[[7-Hydroxy-1-(4-hydroxy-3,5-dimethoxyphenyl)-3-(hydroxymethyl)-6,8-dimethoxy-1,2,3,4-tetrahydronaphthalen-2-yl]methoxy]-6-(hydroxymethyl)oxane-3,4,5-triol (Q104195249)
- HMDB0038959: 2-methyl-6-phytylhydroquinone (Q27145280), (R,R)-2-methyl-6-phytylhydroquinone (Q27145635)
- HMDB0039265: eugeniin (Q7697608), Tellimagrandin II (Q82996103)
- HMDB0039545: ginsenoside F2 (Q27146699), 2-(Hydroxymethyl)-6-[[12-hydroxy-4,4,8,10,14-pentamethyl-17-[6-methyl-2-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyhept-5-en-2-yl]-2,3,5,6,7,9,11,12,13,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]oxane-3,4,5-triol (Q105262701)
- HMDB0039546: ginsenoside Rg3 (Q27077807), 2-((4,5-dihydroxy-2-((12-hydroxy-17-(2-hydroxy-6-methylhept-5-en-2-yl)-4,4,8,10,14-pentamethylhexadecahydro-1H-cyclopenta[a]phenanthren-3-yl)oxy)-6-(hydroxymethyl)tetrahydro-2H-pyran-3-yl)oxy)-6-(hydroxymethyl)tetrahydro-2H-pyran-3,4,5-triol (Q105246825)
- HMDB0039555: ginsenoside F1 (Q27146705), panaxoside A progenin (Q105331648)
- HMDB0039687: Oryzalexin S (Q65660465), 6-(Hydroxymethyl)-2,6,12-trimethyltetracyclo[11.2.1.01,10.02,7]hexadec-11-en-4-ol (Q110078265)
- HMDB0040304: cyclocommunol (Q72459455), cyclocommunol (Q105286533)
- HMDB0040454: lucialdehyde C (Q27135209), (2E)-6-{7-hydroxy-3a,6,6,9a,11a-pentamethyl-4-oxo-1H,2H,3H,5H,5aH,7H,8H,9H,10H,11H-cyclopenta[a]phenanthren-1-yl}-2-methylhept-2-enal (Q105209626)
- HMDB0040486: quercetin 3-O-beta-D-glucopyranosyl-(1->2)-rhamnopyranoside (Q27134830), Quercetin 3-(2-glucosylrhamnoside) (Q104978068)
- HMDB0040723: gossypol (Q411882), (-)-gossypol (Q29652363), (+)-gossypol (Q29652392)
- HMDB0040974: laurolitsine (Q27135167), Norboldine (Q104394920)
- HMDB0041055: (+)-phytocassane B (Q27140060), 2-ethenyl-5,6,7-trihydroxy-1,4b,8,8-tetramethyl-4a,5,6,7,8a,9,10,10a-octahydro-1H-phenanthren-4-one (Q105327221)
- HMDB0041058: (+)-phytocassane C (Q23804989), 2-ethenyl-5,7-dihydroxy-1,4b,8,8-tetramethyl-4a,5,6,7,8a,9,10,10a-octahydro-1H-phenanthren-4-one (Q105352196)
- HMDB0041193: kanzonol p (Q27137438), 9-Hydroxy-1,3-dimethoxy-2-prenylpterocarpan (Q105371092)
- HMDB0041263: malonyldaidzin (Q27149376), 6''-O-Malonyldaidzin (Q105171946)
- HMDB0041310: (2S)-luteoforol (Q3268003), (±)-luteoforol (Q82903126)
- HMDB0041836: benzoylecgonine (Q2499888), (2s,3s)-3-(benzoyloxy)-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylic acid (Q82028889)
- HMDB0041861: cyanuric acid (Q411314), isocyanuric acid (Q106345641)
- HMDB0041920: loxoprofen (Q2759348), loxoprofen sodium dihydrate (Q27114685)
- HMDB0041931: MDMA (Q69488), 3,4-methylenedioxyamphetamine (Q223020)
- HMDB0041993: O-pivaloylcarnitine (Q27158863), 3-[(2,2-Dimethylpropanoyl)oxy]-4-(trimethylazaniumyl)butanoate (Q82883921)
- HMDB0042011: (S)-phenylmercapturic acid (Q22159020), 2-acetamido-3-(phenylthio)propionic acid (Q26841334)
- HMDB0045188: 1-stearoyl-2-arachidonoyl-3-oleoyl-sn-glycerol (Q27145504), TG(18:0/20:4(5Z,8Z,11Z,14Z)/18:1(9Z)) (Q76876142)
- HMDB0059604: coprostanone (Q27098364), cholestan-3-one (Q105207311)
- HMDB0059659: trans-3-hydroxy-L-proline (Q23804983), trans-3-hydroxy-L-proline zwitterion (Q106345488)
- HMDB0059726: 4-carene (Q27162117), cis-(-)-4-carene (Q106520201)
- HMDB0059876: (R)-pantolactone (Q27102042), (3R)-3,4,4-trimethyloxolan-2-one (Q76754298)
- HMDB0059884: (±)-2-carene (Q81986195), (-)-2-carene (Q106520188)
- HMDB0059906: megastigmatrienone a (Q22137252), megastigmatrienone (Q106045242)
- HMDB0059912: indigotindisulfonate sodium (Q410120), indigotindisulfonic acid (Q27162327)
- HMDB0060245: β-Cyano-L-alanine (Q27075129), 3-cyano-L-alanine zwitterion (Q106345494)
- HMDB0060431: 8,9-Dihydro-8-(S-glutathionyl)-9-hydroxyaflatoxin B1 (Q27105692), 2-amino-5-[[1-(carboxymethylamino)-3-[[(4R,5S)-4-hydroxy-11-methoxy-16,18-dioxo-6,8,19-trioxapentacyclo[10.7.0.02,9.03,7.013,17]nonadeca-1,9,11,13(17)-tetraen-5-yl]sulfanyl]-1-oxopropan-2-yl]amino]-5-oxopentanoic acid (Q45435642)
- HMDB0060460: cis-4-hydroxy-D-proline (Q27101809), cis-4-hydroxy-D-proline zwitterion (Q106345512)
- HMDB0060485: N-formyl-L-kynurenine (Q27104120), N-formyl-L-kynurenine zwitterion (Q106345554)
- HMDB0060618: 6-aminopenicillanic acid (Q2823234), 6-aminopenicillanic acid zwitterion (Q106345604)
- HMDB0060774: 5-carboxy-2'-deoxyuridine (Q27179272), 1-[(2S,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-2,4-dioxopyrimidine-5-carboxylic acid (Q76084583)
- HMDB0060906: 11-hydroxy-THC (Q722962), 6a,7,8,10a-tetrahydro-1-hydroxy-6,6-dimethyl-3-pentyl-6H-dibenzo(b,d)pyran-9-methanol (Q63396108)
- HMDB0061035: hydroxyitraconazole (Q27237315), 4-(4-{4-[4-({2-(2,4-Dichlorophenyl)-2-[(1H-1,2,4-triazol-1-yl)methyl]-1,3-dioxolan-4-yl}methoxy)phenyl]piperazin-1-yl}phenyl)-2-(3-hydroxybutan-2-yl)-2,4-dihydro-3H-1,2,4-triazol-3-one (Q82893549)
- HMDB0061656: (3S)-3-hydroxymyristic acid (Q27117123), (+/-)-3-hydroxymyristic acid (Q27158359)
- HMDB0061877: γ-amino-β-hydroxybutyric acid (Q5520257), gamma-amino-beta-hydroxybutyric acid zwitterion (Q106345672)
- HMDB0061904: (E)-2-octene (Q24735790), 2-octene (Q30104056)
- HMDB0062563: 4-maleylacetoacetic acid (Q2823225), 4,6-Dioxooct-2-enedioic acid (Q115966040)
- HMDB0062577: phorate (Q421197), phosphatidylcholines (Q650187)
- HMDB0062715: N-acetyl-L-2-aminoadipate(2-) (Q73400344), N-acetyl-L-2-aminoadipate (Q115966171)
- HMDB0094692: N-methyl-L-alanine (Q27102436), N-methyl-L-alanine zwitterion (Q106345539)
- HMDB0240311: 8-hydroxyquinolin-2(1H)-one (Q72505883), quinoline-2,8-diol (Q74417603)
- HMDB0240650: ectoine (Q414414), ectoine zwitterion (Q106345647)
- HMDB0242219: LSM-6390 (Q27166906), parthenolide (Q72499560)
- HMDB0242475: bifenthrin (Q415150), Cyclopropanecarboxylic acid, 3-[(1Z)-2-chloro-3,3,3-trifluoro-1-propenyl]-2,2-dimethyl-, (2-methyl[1,1'-biphenyl]-3-yl)methyl ester, (1R,3R)-rel- (Q81977693)
- HMDB0243518: (±)-norephedrine (Q59627745), phenylpropanolamine (Q97786582)
- HMDB0243534: 3-methylfentanyl (Q2030844), cis-3-methylfentanyl (Q81977389), trans-3-methylfentanyl (Q122618283)
- HMDB0243806: (R/S)-PD123319 (Q27163600), (R)-(+)-PD123319 (Q100786783)
- HMDB0244905: 1H-tetrazole (Q58826308), 2H-tetrazole (Q58826418)
- HMDB0245175: 2-Iminiopropanoate (Q27095040), 2-iminiopropionate (Q106365598)
- HMDB0245194: 2-mercaptopyridine (thione form) (Q15274000), 2-mercaptopyridine (thiol form) (Q61739667)
- HMDB0247107: 6H-Purine-6-thione, 2-amino-1,9-dihydro-9-β-D-arabinofuranosyl- (Q90530213), 6H-Purine-6-thione, 2-amino-1,9-dihydro-9-β-D-xylofuranosyl- (Q90530217), 6H-Purine-6-thione, 2-amino-1,9-dihydro-9-β-L-ribofuranosyl- (Q90530221)
- HMDB0249970: methylarginine (Q6823955), N-methyl-D-arginine (Q108028577)
- HMDB0250433: conduritol (Q5159421), (±)-conduritol B (Q106666883)
- HMDB0250761: pyranose (Q424248), glucopyranose (Q23905960)
- HMDB0250766: hexane-1,2,3,4,5,6-hexol (Q27215890), mannitol (Q75079467)
- HMDB0253141: hexahydropyrrolo[1,2-a]pyrazine-1,4-dione (Q72482052), Hexahydropyrrolo[1,2-a]pyrazine-1,4-dione (Q105202167)
- HMDB0255876: 9-(2-deoxy-α-D-erythro-pentofuranosyl)-6-methoxy-9H-purin-2-amine (Q82034934), 9-(2-Deoxypentofuranosyl)-6-methoxy-3,9-dihydro-2H-purin-2-imine (Q82949463)
- HMDB0256965: 3-hydroxypyridin-4(1H)-one (Q27891533), pyridine-3,4-diol (Q74411505)
- HMDB0257247: nitrofurazone (Q425502), (2Z)-2-[(5-nitro-2-furanyl)methylene]hydrazinecarboxamide (Q103965033)
- HMDB0258237: Sennosides (Q105117423), sennoside G (Q106636323)
- HMDB0258835: triglycidyl isocyanurate (Q2453240), teroxirone (Q106636470)
- HMDB0259980: zabofloxacin (Q27283202), (Z)-zabofloxacin (Q106615455)
- HMDB0301903: malvidin-3-O-(6-O-cis-p-coumaryl-beta-D-glucoside) (Q106010164), Malvidin 3-(6''-p-coumarylglucoside) (Q106010167)
- HMDB0301904: malvidin 3-O-{6-O-[(Z)-caffeoyl]-beta-D-glucoside} (Q106010172), malvidin 3-O-{6-O-[(E)-caffeoyl]-beta-D-glucoside} (Q106010173)
- HMDB0302074: methyl 4-hydroxycinnamate (Q72491282), methyl hydroxycinnamate (Q105179998)
- HMDB0303990: beta-farnesene (Q27119784), beta-farnesene (Q106339618)
- HMDB0304227: 2-amino-6-(hydroxymethyl)-7,8-dihydropteridin-4-ol (Q27093187), 6-Hydroxymethyl-7,8-dihydropterin (Q106570944)
- HMDB0304228: (2-amino-4-hydroxy-7,8-dihydropteridin-6-yl)methyl diphosphate(3−) (Q57826859), (7,8-dihydropterin-6-yl)methyl diphosphate(3-) (Q74417501)
"Single value" violations edit
Violations count: 184
- nicotine (Q12144): HMDB0001934, HMDB0243542
- urocanic acid (Q30536): HMDB0000301, HMDB0062562
- i-urobilinogen (Q57054): HMDB0004158, HMDB0001898
- allysine (Q61298): HMDB0001263, HMDB0303320
- MDMA (Q69488): HMDB0041931, HMDB0254382
- carbonic acid (Q104334): HMDB0003538, HMDB0000595
- tetrahydrofolic acid (Q168453): HMDB0001846, HMDB0243631
- pantothenic acid (Q179894): HMDB0000210, HMDB0250782
- nitrate ion (Q182168): HMDB0002878, HMDB0015021
- phosphoric acid (Q184782): HMDB0002142, HMDB0001429
- tetrahydrocannabinol (Q190067): HMDB0041865, HMDB0014613
- DL-panthenol (Q196473): HMDB0004231, HMDB0304820
- (R)-mevalonic acid (Q241678): HMDB0059629, HMDB0000227
- D-mannopyranose 6-phosphate (Q259546): HMDB0001078, HMDB0304312
- DL-α-aminobutyric acid (Q285687): HMDB0000650, HMDB0245013
- pyrophosphate anion (Q290828): HMDB0000250, HMDB0304340
- ubidecarenone (Q321285): HMDB01072, HMDB0001072
- edaravone (Q335099): HMDB0006240, HMDB0251697
- ethylene oxide (Q407473): HMDB0031305, HMDB0255987
- Ketoconazole (Q407883): HMDB0012242, HMDB0243587
- pulegone (Q413816): HMDB0061794, HMDB0035604
- trans-caffeic acid (Q414116): HMDB0003501, HMDB0001964
- chlordimeform (Q415341): HMDB0303735, HMDB0250093
- (RS)-fenfluramine (Q418928): HMDB0015322, HMDB0252200
- sapropterin (Q419808): HMDB0000027, HMDB0000787
- podofilox (Q421193): HMDB0031452, HMDB0015310
- retinal (Q422001): HMDB0001358, HMDB0244342
- stercobilin (Q422863): HMDB0004159, HMDB0240259
- ranitidine (Q423037): HMDB0001930, HMDB0259516
- diethylstilbestrol (Q423989): HMDB0014400, HMDB0302859
- oxalosuccinic acid (Q424172): HMDB0003974, HMDB0304444
- glucaric acid (Q424636): HMDB0029881, HMDB0000663
- nitrofurazone (Q425502): HMDB0014480, HMDB0257247
- queuosine (Q425950): HMDB0011596, HMDB0059662
- cefapirin (Q549803): HMDB0015270, HMDB0030451
- 3'-fucosyllactose (Q617126): HMDB0002094, HMDB0006620
- 11-hydroxy-THC (Q722962): HMDB0060906, HMDB0062581
- D-(+)-neopterin (Q908292): HMDB0002275, HMDB0000845
- nizatidine (Q1188290): HMDB0014723, HMDB0259636
- 2,3-diketogulonic acid (Q1225282): HMDB0006511, HMDB0005971
- diisobutyl ketone (Q2416556): HMDB0013821, HMDB0031417
- (2E)-2-octenal (Q2448755): HMDB0013809, HMDB0302984
- furazolidone (Q2467555): HMDB0014752, HMDB0247183
- DL-dipalmitoylphosphatidylcholine (Q2587934): HMDB0000564, HMDB0245715
- O-phospho-L-serine (Q2701649): HMDB0001721, HMDB0000272
- glyceryl 1-phosphate (Q2739882): HMDB0000126, HMDB0252849
- α-aminoadipic acid (Q2823204): HMDB0000510, HMDB0302754
- 3-ureidoisobutyric acid (Q2823221): HMDB0002031, HMDB0304156
- 4-maleylacetoacetic acid (Q2823225): HMDB0062563, HMDB0002052
- docosapentaenoic acid (Q2823253): HMDB0001976, HMDB0013123
- anisyl acetate (Q2823825): HMDB0002072, HMDB0033761
- butyryl-CoA (Q2929006): HMDB0001088, HMDB0304279
- dihydrothymine (Q3027885): HMDB0000079, HMDB0304210
- methyl hexanoate (Q3135043): HMDB35238, HMDB0035238
- iron(III) (Q3233795): HMDB0012943, HMDB0015531
- oxiglutatione (Q3324838): HMDB0000656, HMDB0003337
- neohesperidose (Q3347120): HMDB0029523, HMDB0302540
- apigenin 7-O-neohesperidoside (Q3429675): HMDB0038848, HMDB0303149
- virginiamycin group (Q3560696): HMDB0030520, HMDB0259836
- epi-inositol (Q3589114): HMDB0006088, HMDB0240207
- cevimeline (Q3665683): HMDB0014331, HMDB0249928
- 2-methoxy-4-vinylphenol (Q4596898): HMDB0013744, HMDB0013819
- Dihydrobiopterin (Q5276421): HMDB0000038, HMDB0247294
- glycochenodeoxycholic acid (Q5572600): HMDB0000637, HMDB0006898
- 3α-androstanediol (Q6590364): HMDB0000495, HMDB0000554
- DL-methionine (RS)-S-oxide (Q6823656): HMDB0002005, HMDB0250776
- pregnenolone sulfate (Q7239912): HMDB0000774, HMDB0060382
- L-thialysine (Q7387052): HMDB0033518, HMDB0029178
- GM1 (stereochemistry not completely specified) (Q10860794): HMDB0004855, HMDB0304760
- hydroxyproline (Q12460151): HMDB0000725, HMDB0036576
- thyrotropin-releasing hormone (Q12910980): HMDB0005763, HMDB0060080
- (-)-car-3-ene (Q15222645): HMDB0035087, HMDB0034697
- 3-O-methyldopa (Q15410220): HMDB0001434, HMDB0060747
- (17R/S)-avenasterol (Q15410253): HMDB0002374, HMDB0302673
- dityrosine (Q15889293): HMDB0006045, HMDB0254132
- selenophosphoric acid (Q20861498): HMDB0006407, HMDB0003840
- trans-3-hydroxy-L-proline (Q23804983): HMDB0002113, HMDB0059659
- β-D-glucopyranose (Q23905968): HMDB0000516, HMDB0000122
- 4a-hydroxytetrahydrobiopterin (Q24063330): HMDB0002281, HMDB0304198
- nisinic acid (Q24063589): HMDB0013025, HMDB0002007
- p-tert-pentylphenol (Q26840951): HMDB0013825, HMDB0246582
- NADP+ (Q26987754): HMDB0000217, HMDB0304435
- 18-HETE (Q27070791): HMDB0006245, HMDB0062302
- 18R-HEPE (Q27070792): HMDB0012611, HMDB0062222
- 4-trimethylammoniobutanoate (Q27073962): HMDB0006831, HMDB0001161
- (S)-3-hydroxybutyric acid (Q27075158): HMDB0000758, HMDB0000442
- taurocyamine (Q27077930): HMDB03584, HMDB0003584
- lysophosphatidylserine (Q27083342): HMDB0061698, HMDB0240606
- pp-242 (Q27088430): HMDB0060607, HMDB0256714
- UDP-N-acetylgalactosamine (Q27089067): HMDB0000304, HMDB0060522
- (-)-limonene (Q27089405): HMDB0003375, HMDB0004321
- (-)-α-fenchyl alcohol (Q27089421): HMDB0034932, HMDB0303866
- 4-Hydroxybenzoyl Coenzyme A (Q27089482): HMDB0006467, HMDB0060140
- S-methylcysteine (Q27093260): HMDB0002108, HMDB0302211
- cis-vaccenic acid (Q27095533): HMDB0003231, HMDB0240219
- ADP alpha-D-glucoside (Q27098215): HMDB0065570, HMDB0006557
- coprostanone (Q27098364): HMDB0059604, HMDB0011182
- (R)-pantolactone (Q27102042): HMDB0059876, HMDB0303902
- cis-caffeic acid (Q27102378): HMDB0001964, HMDB0003501
- 3Alpha,7Alpha,12Alpha-trihydroxy-5Beta-cholestan-26-oic acid (Q27103052): HMDB0000601, HMDB0003873
- (S)-3-hydroxydecanoyl-CoA (Q27103637): HMDB0003938, HMDB0303998
- vitamin K epoxide (Q27103659): HMDB0002972, HMDB0245416
- (2-trans,6-cis)-dodeca-2,6-dienoyl-CoA (Q27103668): HMDB0011123, HMDB0062630
- decanoyl-CoA (Q27103740): HMDB0006404, HMDB0304325
- N-formyl-L-kynurenine (Q27104120): HMDB0001200, HMDB0060485
- cholesteryl (7Z,10Z,13Z,16Z,19Z)-docosapentaenoate (Q27105016): HMDB0010375, HMDB0062457
- N-palmitoylsphingomyelin (Q27105084): HMDB0061712, HMDB0010169
- isolithocholic acid (Q27105090): HMDB0000713, HMDB0000717
- (+)-linalool (Q27105233): HMDB0036102, HMDB0036101
- (-)-oxedrine (Q27105248): HMDB0004826, HMDB0062811
- (-)-dihydrocarveol (Q27105257): HMDB0035825, HMDB0302262
- 1-caffeoyl-beta-D-glucose (Q27105318): HMDB0036937, HMDB0302440
- 3-sulfinylpyruvic acid (Q27105488): HMDB0002332, HMDB0001405
- (6E)-β-farnesene (Q27108631): HMDB0035913, HMDB0062763
- (+)-neoisomenthol (Q27109029): HMDB0035764, HMDB0041628
- 12-HETE (Q27109114): HMDB0006111, HMDB0244455
- 24-epicampesterol (Q27109255): HMDB0002869, HMDB0034224
- glutaconic acid (Q27109839): HMDB0061185, HMDB0256281
- epidihydrocholesterin (Q27114383): HMDB0000908, HMDB0001569
- (Z)-α-amylcinnamaldehyde (Q27114867): HMDB0061830, HMDB0031313
- batilol (Q27115823): HMDB0011143, HMDB0248884
- 9(S)-HPODE (Q27116110): HMDB0006940, HMDB0062434
- 4-methoxycinnamic acid (Q27121258): HMDB0002040, HMDB0246971
- 1-O-oleoyl-sn-glycero-3-phosphoserine (Q27123529): HMDB0061694, HMDB0240603
- tetracosanoyl-CoA (Q27123825): HMDB0006526, HMDB0060239
- oct-2-enal (Q27131344): HMDB0030961, HMDB0013809
- non-2-enal (Q27131346): HMDB0031269, HMDB0255708
- (+)-γ-cadinene (Q27132468): HMDB0038207, HMDB0302757
- 3,5-dicaffeoylquinic acid (Q27134233): HMDB0030706, HMDB0029280
- N-acetyltyrosine (Q27137011): HMDB0000866, HMDB0244966
- dehydroisoandrosterone 3-glucuronide (Q27137208): HMDB0010327, HMDB0010348
- citronellyl acetate (Q27138814): HMDB0034160, HMDB0037186
- beta-D-GlcpNAc-(1->4)-beta-D-GlcpNAc-(1->4)-beta-D-GlcpNAc (Q27139583): HMDB0006698, HMDB0003362
- zeatin riboside (Q27139815): HMDB0030388, HMDB0304506
- O-succinylcarnitine (Q27140249): HMDB0061717, HMDB0255869
- 3-hydroxyhexadecanoylcarnitine (Q27140278): HMDB0013336, HMDB0061642
- N-hexadecanoylsphingosine 1-phosphate (Q27140346): HMDB0010698, HMDB0010700
- Glu-Lys (Q27140603): HMDB0028824, HMDB0004207
- Ala-Trp (Q27144124): HMDB0028698, HMDB0013209
- 2,3-dinor-6-oxoprostaglandin F1alpha (Q27144266): HMDB0002277, HMDB0062618
- Ile-Pro (Q27144389): HMDB0028915, HMDB0011174
- valyllysine (Q27145073): HMDB0029131, HMDB0029132
- 1-stearoyl-2-palmitoyl-sn-glycero-3-phosphocholine (Q27145082): HMDB0000436, HMDB0008034
- 1,2-dioleoyl-3-palmitoylglycerol (Q27145595): HMDB0005382, HMDB0303020
- 2-palmitoyl-sn-glycero-3-phosphocholine (Q27145730): HMDB0061702, HMDB0240262
- 3-tert-butyl-4-hydroxyanisole (Q27145913): HMDB0031848, HMDB0059925
- L-adenosylselenohomocysteine (Q27146558): HMDB0011117, HMDB0062526
- glyceryl 1,3-dipalmitate (Q27147217): HMDB0056009, HMDB0031011
- N-acetyl-beta-D-galactosaminyl-(1->4)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-N-stearoylsphingosine (Q27147836): HMDB0004898, HMDB0004891
- (5R)-5-hydroxyhexanoic acid (Q27147992): HMDB0000525, HMDB0000409
- (7R)-7-hydroxyoctanoic acid (Q27148030): HMDB0000486, HMDB0062596
- cholesteryl stearate (Q27156278): HMDB0010368, HMDB0062461
- 1-stearoyl-sn-glycero-3-phospho-1D-myo-inositol (Q27156606): HMDB0062777, HMDB0240261
- cholesteryl (9Z)-heptadecenoate (Q27157684): HMDB0060060, HMDB0062454
- (R)-3-hydroxybutyrylcarnitine (Q27158110): HMDB0013127, HMDB0062735
- 2,3-dihydroxybutanoic acid (Q27159093): HMDB0000498, HMDB0245394
- 4alpha-hydroxymethyl-4beta-methyl-5alpha-8-cholesten-3beta-ol (Q27159330): HMDB0012171, HMDB0062391
- 4alpha-Formyl-4beta-methyl-5alpha-cholesta-8-en-3beta-ol (Q27159331): HMDB0012168, HMDB0062388
- 4alpha-methyl-5alpha-cholest-8-en-3-one (Q27159335): HMDB0012174, HMDB0062393
- 5alpha-cholest-8-en-3-one (Q27159340): HMDB0012178, HMDB0062414
- lanost-8-ene-3beta,30-diol (Q27159341): HMDB0012160, HMDB0062380
- 3beta-hydroxylanost-8-en-32-al (Q27159344): HMDB0012159, HMDB0062379
- 3beta-hydroxy-4beta-methyl-5alpha-cholest-8-ene-4alpha-carboxylic acid (Q27159482): HMDB0012165, HMDB0062384
- 4beta-methylzymosterol-4-carbaldehyde (Q27159492): HMDB0012167, HMDB0062387
- 4alpha-hydroxymethyl-4beta-methylzymosterol (Q27159494): HMDB0012170, HMDB0062390
- 4alpha-Carboxy-5alpha-cholesta-8-en-3beta-ol (Q27159498): HMDB0012166, HMDB0062386
- TG(16:0/16:0/18:3(9Z,12Z,15Z))[iso3] (Q27161012): HMDB0010417, HMDB0072668
- 2-methylpyrazine (Q27161158): HMDB33112, HMDB0033112
- Urolithin A-3-O-glucuronide (Q27161277): HMDB0029222, HMDB0240566
- 5-(3',4'-Dihydroxyphenyl)-gamma-valerolactone (Q27161472): HMDB0029185, HMDB0240472
- Urolithin A-8-O-glucuronide (Q27161755): HMDB0060022, HMDB0240568
- TG(16:1(9Z)/18:0/18:0)[iso3] (Q27162142): HMDB0005421, HMDB0044754
- TG(16:1(9Z)/18:1(9Z)/20:0)[iso6] (Q27162270): HMDB0005437, HMDB0045741
- TG(16:1(9Z)/16:1(9Z)/18:0)[iso3] (Q27162277): HMDB0005430, HMDB0044889
- TG(16:1(9Z)/16:1(9Z)/20:0)[iso3] (Q27162278): HMDB0005431, HMDB0045689
- TG(16:1(9Z)/18:2(9Z,12Z)/20:0)[iso6] (Q27162294): HMDB0005444, HMDB0045871
- (S)-2,3-epoxysqualene (Q27453274): HMDB0059621, HMDB0001188
- glyceryl 1-palmitate (Q27887716): HMDB0031074, HMDB0245964
- (+)-limonene (Q27888324): HMDB0004321, HMDB0003375
- D-manno-2-Heptulose (Q47459280): HMDB0003219, HMDB0254327
- 9-hydroxy-10E,12Z-octadecadienoic acid (Q50318263): HMDB0010223, HMDB0062652
- dUDP (Q60573941): HMDB01000, HMDB0001000
- gamma-Glu-Met (Q63399363): HMDB0029155, HMDB0034367
- 3-hydroxyhexanoyl-carnitine (Q66889019): HMDB0061633, HMDB0241677
"Format" violations edit
Violations count: 0
"Format" violations edit
Violations count: 0
"Entity types" violations edit
Violations count: 0
"Scope" violations edit
Violations count: 0