(Q105189379)

English

6-[[8a-[4,5-Dihydroxy-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxycarbonyl-4,4,6a,6b,11,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid

group of stereoisomers with the chemical formula C₄₇H₇₄O₁₇

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instance of

group of stereoisomers

0 references

subclass of

oleanane triterpenoid

1 reference

inferred from

oleanane triterpenoid

mass

910.4926009080006 dalton

1 reference

based on heuristic

inferred from InChI

chemical formula

C₄₇H₇₄O₁₇

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canonical SMILES

O=C(O)C1OC(OC2CCC3(C)C4CC=C5C6CC(C)(C)CCC6(C(=O)OC7OCC(O)C(O)C7OC8OC(C)C(O)C(O)C8O)CCC5(C)C4(C)CCC3C2(C)C)C(O)C(O)C1O

0 references

Identifiers

InChI

InChI=1S/C47H74O17/c1-21-28(49)30(51)33(54)38(60-21)63-36-29(50)24(48)20-59-40(36)64-41(58)47-17-15-42(2,3)19-23(47)22-9-10-26-44(6)13-12-27(61-39-34(55)31(52)32(53)35(62-39)37(56)57)43(4,5)25(44)11-14-46(26,8)45(22,7)16-18-47/h9,21,23-36,38-40,48-55H,10-20H2,1-8H3,(H,56,57)

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InChIKey

OCHWMXWUOZTUSN-UHFFFAOYSA-N

0 references

PubChem CID

162952892

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

OCHWMXWUOZTUSN-UHFFFAOYSA-N

(Q105189379)

6-[[8a-[4,5-Dihydroxy-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxycarbonyl-4,4,6a,6b,11,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid

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