(Q104999491)

English

[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[(4S,6E,10S)-10-hydroxy-2,6,10-trimethyldodeca-2,6,11-trien-4-yl]oxyoxan-2-yl]methyl acetate

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

beta-D-Glucopyranoside, 7-hydroxy-3,7-dimethyl-1-(2-methyl-1-propenyl)-3,8-nonadienyl, 6-acetate

1 reference

based on heuristic

inferred from SMILES

mass

442.256668176 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₃H₃₈O₈

0 references

canonical SMILES

O=C(OCC1OC(OC(C=C(C)C)CC(=CCCC(O)(C=C)C)C)C(O)C(O)C1O)C

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isomeric SMILES

C=C[C@@](C)(O)CC/C=C(\C)C[C@@H](C=C(C)C)O[C@@H]1O[C@H](COC(C)=O)[C@@H](O)[C@H](O)[C@H]1O

0 references

found in taxon

Gaillardia coahuilensis

1 reference

stated in

Pseudoguaianolides and sesquiterpene glucoside from Gaillardia coahuilensis

Identifiers

InChI

InChI=1S/C23H38O8/c1-7-23(6,28)10-8-9-15(4)12-17(11-14(2)3)30-22-21(27)20(26)19(25)18(31-22)13-29-16(5)24/h7,9,11,17-22,25-28H,1,8,10,12-13H2,2-6H3/b15-9+/t17-,18-,19-,20+,21-,22-,23-/m1/s1

0 references

InChIKey

FPZJYGYCCMWHBD-YHOYEKRLSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

FPZJYGYCCMWHBD-YHOYEKRLSA-N

(Q104999491)

[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[(4S,6E,10S)-10-hydroxy-2,6,10-trimethyldodeca-2,6,11-trien-4-yl]oxyoxan-2-yl]methyl acetate

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Identifiers

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