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(Q104990735)
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English
[2,6-dihydroxy-6-methyl-2-(2,3,14-trihydroxy-10,13-dimethyl-6-oxo-2,3,4,5,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-17-yl)heptan-3-yl] 2-hydroxyacetate
group of stereoisomers with the chemical formula C₂₉H₄₆O₉
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Statements
instance of
group of stereoisomers
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subclass of
cholestane steroid
1 reference
inferred from
cholestane steroid
mass
538.3141830519997
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₉H₄₆O₉
0 references
canonical SMILES
O=C(OC(CCC(O)(C)C)C(O)(C)C1CCC2(O)C3=CC(=O)C4CC(O)C(O)CC4(C)C3CCC12C)CO
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Identifiers
InChI
InChI=1S/C29H46O9/c1-25(2,35)9-8-23(38-24(34)15-30)28(5,36)22-7-11-29(37)17-12-19(31)18-13-20(32)21(33)14-26(18,3)16(17)6-10-27(22,29)4/h12,16,18,20-23,30,32-33,35-37H,6-11,13-15H2,1-5H3
0 references
InChIKey
DWTMLGDZGORWQW-UHFFFAOYSA-N
0 references
PubChem CID
73836897
1 reference
based on heuristic
inferred from InChIKey
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