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(Q105116475)
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English
methyl 10-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-3-oxo-4,5,6,6a,7,8,8a,10,11,12-decahydro-1H-picene-4a-carboxylate
group of stereoisomers with the chemical formula C₃₁H₄₆O₄
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Statements
instance of
group of stereoisomers
0 references
subclass of
oleanane triterpenoid
1 reference
inferred from
oleanane triterpenoid
mass
482.3396099519999
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₃₁H₄₆O₄
0 references
canonical SMILES
O=C(OC)C12C(=C3C=CC4C5(C)CCC(O)C(C)(C)C5CCC4(C)C3(C)CC1)CC(C(=O)C2)(C)C
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Identifiers
InChI
InChI=1S/C31H46O4/c1-26(2)17-20-19-9-10-22-28(5)13-12-23(32)27(3,4)21(28)11-14-30(22,7)29(19,6)15-16-31(20,18-24(26)33)25(34)35-8/h9-10,21-23,32H,11-18H2,1-8H3
0 references
InChIKey
INXJIILGAQGOED-UHFFFAOYSA-N
0 references
PubChem CID
163035166
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
INXJIILGAQGOED-UHFFFAOYSA-N
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