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(Q104922486)
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English
5-hydroxy-6a-(hydroxymethyl)-4,4a,6b,8a,11,11,14a-heptamethyl-2,4,5,6,6a,7,8,9,10,12,12a,13,14,14b-tetradecahydro-1H-picen-3-one
group of stereoisomers with the chemical formula C₃₀H₅₀O₃
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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
458.3759954599999
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₃₀H₅₀O₃
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canonical SMILES
O=C1CCC2C3(C)CCC4(CO)C5CC(C)(C)CCC5(C)CCC4(C)C3CC(O)C2(C)C1C
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Identifiers
InChI
InChI=1S/C30H50O3/c1-19-20(32)8-9-21-27(5)13-15-30(18-31)23-17-25(2,3)10-11-26(23,4)12-14-28(30,6)22(27)16-24(33)29(19,21)7/h19,21-24,31,33H,8-18H2,1-7H3
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InChIKey
BAVSTNWTZRNSDO-UHFFFAOYSA-N
0 references
PubChem CID
162879565
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
BAVSTNWTZRNSDO-UHFFFAOYSA-N
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