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(Q105156439)
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English
3a,5a,5b,8,8,11a-Hexamethyl-1-propan-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13b-tetradecahydrocyclopenta[a]chrysen-9-ol
group of stereoisomers with the chemical formula C₃₀H₅₀O
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Statements
instance of
group of stereoisomers
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subclass of
lupane
1 reference
inferred from
lupane
mass
426.7185
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₃₀H₅₀O
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canonical SMILES
OC1CCC2(C)C(CCC3(C)C2CC=C4C5C(CCC5(C)CCC43C)C(C)C)C1(C)C
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Identifiers
InChI
InChI=1S/C30H50O/c1-19(2)20-11-14-27(5)17-18-29(7)21(25(20)27)9-10-23-28(6)15-13-24(31)26(3,4)22(28)12-16-30(23,29)8/h9,19-20,22-25,31H,10-18H2,1-8H3
0 references
InChIKey
LSACXWBGTOJFEP-UHFFFAOYSA-N
0 references
PubChem CID
78178079
1 reference
based on heuristic
inferred from InChIKey
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