(Q105304494)

English

3-[3-(2-hydroxy-6-methyl-5-methylideneheptan-2-yl)-6,9a,9b-trimethyl-7-(prop-1-en-2-yl)-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-decahydrocyclopenta[a]naphthalen-6-yl]propanoic acid

group of stereoisomers with the chemical formula C₃₇H₆₂O₉

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instance of

group of stereoisomers

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subclass of

chemical compound

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mass

650.4393835640001 dalton

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based on heuristic

inferred from InChI

chemical formula

C₃₇H₆₂O₉

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canonical SMILES

O=C(O)CCC1(C)C(C(=C)C)CCC2(C)C1CC(OC3OC(CO)C(O)C(O)C3O)C4C(CCC42C)C(O)(C)CCC(=C)C(C)C

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Identifiers

InChI

InChI=1S/C37H62O9/c1-20(2)22(5)10-17-37(9,44)24-12-16-36(8)29(24)25(45-33-32(43)31(42)30(41)26(19-38)46-33)18-27-34(6,14-13-28(39)40)23(21(3)4)11-15-35(27,36)7/h20,23-27,29-33,38,41-44H,3,5,10-19H2,1-2,4,6-9H3,(H,39,40)

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InChIKey

WGHKIPWWQPGCRZ-UHFFFAOYSA-N

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PubChem CID

14707639

1 reference

matched by identifier from

InChIKey

WGHKIPWWQPGCRZ-UHFFFAOYSA-N

(Q105304494)

3-[3-(2-hydroxy-6-methyl-5-methylideneheptan-2-yl)-6,9a,9b-trimethyl-7-(prop-1-en-2-yl)-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-decahydrocyclopenta[a]naphthalen-6-yl]propanoic acid

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