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(Q105030079)
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English
methyl 10-(acetyloxy)-1,2,6a,6b,9,9,12a-heptamethyl-2,3,4,5,6,7,8,8a,10,11,12,12b,13,14b-tetradecahydro-1H-picene-4a-carboxylate
group of stereoisomers with the chemical formula C₃₃H₅₂O₄
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Statements
instance of
group of stereoisomers
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subclass of
taraxastane / ursane triterpenoid
1 reference
inferred from
taraxastane / ursane triterpenoid
mass
512.3865601439999
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₃₃H₅₂O₄
0 references
canonical SMILES
O=C(OC1CCC2(C)C(CCC3(C)C2CC=C4C5C(C)C(C)CCC5(C(=O)OC)CCC43C)C1(C)C)C
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Identifiers
InChI
InChI=1S/C33H52O4/c1-20-12-17-33(28(35)36-9)19-18-31(7)23(27(33)21(20)2)10-11-25-30(6)15-14-26(37-22(3)34)29(4,5)24(30)13-16-32(25,31)8/h10,20-21,24-27H,11-19H2,1-9H3
0 references
InChIKey
HLBZSQOUBVLLLL-UHFFFAOYSA-N
0 references
PubChem CID
15598285
1 reference
matched by identifier from
InChIKey
InChIKey
HLBZSQOUBVLLLL-UHFFFAOYSA-N
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