(Q105329246)

English

(2S,3R,4S,5S,6R)-2-[[(5S,8R)-1-hydroxy-5-[(2R)-1-hydroxypropan-2-yl]-3,8-dimethyl-5,6,7,8-tetrahydronaphthalen-2-yl]oxy]-6-[[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxymethyl]oxane-3,4,5-triol

chemical compound

In more languages

edit

Statements

instance of

type of chemical entity

0 references

subclass of

2-[[1-Hydroxy-5-(1-hydroxypropan-2-yl)-3,8-dimethyl-5,6,7,8-tetrahydronaphthalen-2-yl]oxy]-6-[(3,4,5-trihydroxyoxan-2-yl)oxymethyl]oxane-3,4,5-triol

1 reference

based on heuristic

inferred from SMILES

mass

544.25197672 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(2S,3R,4S,5S,6R)-2-[[(5S,8R)-1-hydroxy-5-[(2S)-1-hydroxypropan-2-yl]-3,8-dimethyl-5,6,7,8-tetrahydronaphthalen-2-yl]oxy]-6-[[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxymethyl]oxane-3,4,5-triol

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₂₆H₄₀O₁₂

0 references

canonical SMILES

OC=1C(OC2OC(COC3OCC(O)C(O)C3O)C(O)C(O)C2O)=C(C=C4C1C(C)CCC4C(C)CO)C

0 references

isomeric SMILES

Cc1cc2c(c(O)c1O[C@@H]1O[C@H](CO[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]1O)[C@H](C)CC[C@H]2[C@@H](C)CO

0 references

found in taxon

Alangium premnifolium

1 reference

stated in

Sesquiterpene glycosides and sesquilignan glycosides from stems of Alangium premnifolium

Identifiers

InChI

InChI=1S/C26H40O12/c1-10-4-5-13(12(3)7-27)14-6-11(2)24(20(31)17(10)14)38-26-23(34)21(32)19(30)16(37-26)9-36-25-22(33)18(29)15(28)8-35-25/h6,10,12-13,15-16,18-19,21-23,25-34H,4-5,7-9H2,1-3H3/t10-,12+,13+,15-,16-,18+,19-,21+,22-,23-,25+,26+/m1/s1

0 references

InChIKey

XJVQGOKRTPWSGD-MFRJEYCMSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

XJVQGOKRTPWSGD-MFRJEYCMSA-N

(Q105329246)

(2S,3R,4S,5S,6R)-2-[[(5S,8R)-1-hydroxy-5-[(2R)-1-hydroxypropan-2-yl]-3,8-dimethyl-5,6,7,8-tetrahydronaphthalen-2-yl]oxy]-6-[[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxymethyl]oxane-3,4,5-triol

Statements

Identifiers

Sitelinks

Wikipedia(0 entries)

Wikibooks(0 entries)

Wikinews(0 entries)

Wikiquote(0 entries)

Wikisource(0 entries)

Wikiversity(0 entries)

Wikivoyage(0 entries)

Wiktionary(0 entries)

Multilingual sites(0 entries)