(Q105174502)

English

1,11-Dihydroxy-1,2,6a,6b,9,9,12a-heptamethyl-10-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid

group of stereoisomers with the chemical formula C₃₆H₅₈O₉

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instance of

group of stereoisomers

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subclass of

taraxastane / ursane triterpenoid

1 reference

inferred from

taraxastane / ursane triterpenoid

mass

634.408083436 dalton

1 reference

based on heuristic

inferred from InChI

chemical formula

C₃₆H₅₈O₉

0 references

canonical SMILES

O=C(O)C12CCC(C)C(O)(C)C2C3=CCC4C5(C)CC(O)C(OC6OC(C)C(O)C(O)C6O)C(C)(C)C5CCC4(C)C3(C)CC1

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Identifiers

InChI

InChI=1S/C36H58O9/c1-18-11-14-36(30(41)42)16-15-33(6)20(27(36)35(18,8)43)9-10-23-32(5)17-21(37)28(31(3,4)22(32)12-13-34(23,33)7)45-29-26(40)25(39)24(38)19(2)44-29/h9,18-19,21-29,37-40,43H,10-17H2,1-8H3,(H,41,42)

0 references

InChIKey

MXQDZWQIRGRELN-UHFFFAOYSA-N

0 references

PubChem CID

85184080

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

MXQDZWQIRGRELN-UHFFFAOYSA-N

(Q105174502)

1,11-Dihydroxy-1,2,6a,6b,9,9,12a-heptamethyl-10-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid

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Identifiers

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