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(Q105117601)
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English
10-hydroxy-9-(hydroxymethyl)-2,2,4a,6a,6b,9,12a-heptamethyl-4,5,6,6a,7,8,8a,10,11,12,13,14b-dodecahydro-1H-picen-3-one
group of stereoisomers with the chemical formula C₃₀H₄₈O₃
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Statements
instance of
group of stereoisomers
0 references
subclass of
oleanane triterpenoid
1 reference
inferred from
oleanane triterpenoid
mass
456.3603453959999
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₃₀H₄₈O₃
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canonical SMILES
O=C1CC2(C)CCC3(C(=CCC4C5(C)CCC(O)C(C)(CO)C5CCC43C)C2CC1(C)C)C
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Identifiers
InChI
InChI=1S/C30H48O3/c1-25(2)16-20-19-8-9-22-27(4)12-11-23(32)28(5,18-31)21(27)10-13-30(22,7)29(19,6)15-14-26(20,3)17-24(25)33/h8,20-23,31-32H,9-18H2,1-7H3
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InChIKey
IPZBDVYNLAGJFF-UHFFFAOYSA-N
0 references
PubChem CID
75018547
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
IPZBDVYNLAGJFF-UHFFFAOYSA-N
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