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(Q105280583)
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English
methyl 3,4,5-trihydroxy-6-[(8-hydroxy-4,4,6a,6b,11,11,14b-heptamethyl-8a-{[(3,4,5-trihydroxyoxan-2-yl)oxy]carbonyl}-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl)oxy]oxane-2-carboxylate
group of stereoisomers with the chemical formula C₄₂H₆₆O₁₄
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Statements
instance of
group of stereoisomers
0 references
subclass of
oleanane triterpenoid
1 reference
inferred from
oleanane triterpenoid
mass
794.4452567920005
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₄₂H₆₆O₁₄
0 references
canonical SMILES
O=C(OC)C1OC(OC2CCC3(C)C(CCC4(C)C3CC=C5C6CC(C)(C)CCC6(C(=O)OC7OCC(O)C(O)C7O)C(O)CC54C)C2(C)C)C(O)C(O)C1O
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Identifiers
InChI
InChI=1S/C42H66O14/c1-37(2)15-16-42(36(51)56-34-30(48)27(45)22(43)19-53-34)21(17-37)20-9-10-24-39(5)13-12-26(54-35-31(49)28(46)29(47)32(55-35)33(50)52-8)38(3,4)23(39)11-14-40(24,6)41(20,7)18-25(42)44/h9,21-32,34-35,43-49H,10-19H2,1-8H3
0 references
InChIKey
UWVQPOSPJMYNFO-UHFFFAOYSA-N
0 references
PubChem CID
14634649
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
UWVQPOSPJMYNFO-UHFFFAOYSA-N
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