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(Q105008889)
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English
3a,7-dihydroxy-1-[5-(3-hydroxy-3-methylbutyl)-2,2,4-trimethyl-1,3-dioxolan-4-yl]-9a,11a-dimethyl-1H,2H,3H,5aH,6H,7H,8H,9H,9bH,10H,11H-cyclopenta[a]phenanthren-5-one
group of stereoisomers with the chemical formula C₃₀H₄₈O₆
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Statements
instance of
group of stereoisomers
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subclass of
cholestane steroid
1 reference
based on heuristic
inferred from SMILES
mass
504.3450892559998
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₃₀H₄₈O₆
0 references
canonical SMILES
O=C1C=C2C(CCC3(C)C(CCC23O)C4(OC(OC4CCC(O)(C)C)(C)C)C)C5(C)CCC(O)CC15
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Identifiers
InChI
InChI=1S/C30H48O6/c1-25(2,33)12-11-24-29(7,36-26(3,4)35-24)23-10-15-30(34)20-17-22(32)21-16-18(31)8-13-27(21,5)19(20)9-14-28(23,30)6/h17-19,21,23-24,31,33-34H,8-16H2,1-7H3
0 references
InChIKey
GIDOJSDRNURPMM-UHFFFAOYSA-N
0 references
PubChem CID
14828329
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
GIDOJSDRNURPMM-UHFFFAOYSA-N
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