(Q105162855)

English

[4,5-Dihydroxy-6-(hydroxymethyl)-3-(3,4,5-trihydroxyoxan-2-yl)oxyoxan-2-yl] 1,10,11-trihydroxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate

group of stereoisomers with the chemical formula C₄₁H₆₆O₁₅

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Statements

instance of

group of stereoisomers

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subclass of

oleanane triterpenoid

1 reference

inferred from

oleanane triterpenoid

mass

798.4401714120004 dalton

1 reference

based on heuristic

inferred from InChI

chemical formula

C₄₁H₆₆O₁₅

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canonical SMILES

O=C(OC1OC(CO)C(O)C(O)C1OC2OCC(O)C(O)C2O)C34CCC(C)(C)C(O)C4C5=CCC6C7(C)CC(O)C(O)C(C)(CO)C7CCC6(C)C5(C)CC3

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Identifiers

InChI

InChI=1S/C41H66O15/c1-36(2)11-13-41(35(52)56-34-30(28(48)27(47)22(16-42)54-34)55-33-29(49)26(46)21(45)17-53-33)14-12-39(5)19(25(41)32(36)51)7-8-24-37(3)15-20(44)31(50)38(4,18-43)23(37)9-10-40(24,39)6/h7,20-34,42-51H,8-18H2,1-6H3

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InChIKey

MFMWRSFRXIOHIV-UHFFFAOYSA-N

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PubChem CID

73818312

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

MFMWRSFRXIOHIV-UHFFFAOYSA-N

(Q105162855)

[4,5-Dihydroxy-6-(hydroxymethyl)-3-(3,4,5-trihydroxyoxan-2-yl)oxyoxan-2-yl] 1,10,11-trihydroxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate

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