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(Q105149749)
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English
11-hydroxy-2,2,6a,6a,8a,9,14a-heptamethyl-10-oxo-3,4,5,6,6b,7,8,9,11,12,12a,13,14,14b-tetradecahydro-1H-picene-4a-carboxylic acid
group of stereoisomers with the chemical formula C₃₀H₄₈O₄
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Statements
instance of
group of stereoisomers
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subclass of
friedelane triterpenoid
1 reference
inferred from
friedelane triterpenoid
mass
472.7009
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₃₀H₄₈O₄
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canonical SMILES
O=C(O)C12CCC(C)(C)CC1C3(C)CCC4(C)C(CCC5(C)C(C(=O)C(O)CC54)C)C3(C)CC2
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Identifiers
InChI
InChI=1S/C30H48O4/c1-18-23(32)19(31)16-21-26(18,4)9-8-20-27(21,5)11-12-29(7)22-17-25(2,3)10-14-30(22,24(33)34)15-13-28(20,29)6/h18-22,31H,8-17H2,1-7H3,(H,33,34)
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InChIKey
LCBMALNDBNCPPY-UHFFFAOYSA-N
0 references
PubChem CID
162930687
1 reference
based on heuristic
inferred from InChIKey
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