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(Q105352645)
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English
3-{4-[(6-Deoxyhexofuranosyl-5-ulose)oxy]-3-hydroxyphenyl}-2-methyl-N-(4,6,7-trihydroxyhexahydro-2H-1,3-benzodioxol-5-yl)prop-2-enamide
group of stereoisomers with the chemical formula C₂₃H₂₉NO₁₂
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Statements
instance of
group of stereoisomers
0 references
subclass of
cinnamoylamide alkaloid
1 reference
inferred from
cinnamoylamide alkaloid
mass
511.168975368
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₃H₂₉NO₁₂
0 references
canonical SMILES
CC(=O)C1OC(Oc2ccc(C=C(C)C(=O)NC3C(O)C(O)C4OCOC4C3O)cc2O)C(O)C1O
0 references
found in taxon
Streptomyces hygroscopicus
1 reference
stated in
Pentalenolactone I and hygromycin A, immunosuppressants produced by Streptomyces filipinensis and Streptomyces hygroscopicus
Identifiers
InChI
InChI=1S/C23H29NO12/c1-8(22(32)24-13-14(27)16(29)21-20(15(13)28)33-7-34-21)5-10-3-4-12(11(26)6-10)35-23-18(31)17(30)19(36-23)9(2)25/h3-6,13-21,23,26-31H,7H2,1-2H3,(H,24,32)
0 references
InChIKey
YQYJSBFKSSDGFO-UHFFFAOYSA-N
0 references
PubChem CID
72972433
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
Human Metabolome Database ID
HMDB0253302
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
YQYJSBFKSSDGFO-UHFFFAOYSA-N
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