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(Q105133392)
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English
17-(3,6-Dihydroxy-6-methylheptan-2-yl)-3,5,14-trihydroxy-10,13-dimethyl-1,2,3,4,9,11,12,15,16,17-decahydrocyclopenta[a]phenanthren-6-one
group of stereoisomers with the chemical formula C₂₇H₄₄O₆
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Statements
instance of
group of stereoisomers
0 references
subclass of
cholestane steroid
1 reference
inferred from
cholestane steroid
mass
464.3137891279998
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₇H₄₄O₆
0 references
canonical SMILES
O=C1C=C2C(CCC3(C)C(CCC23O)C(C)C(O)CCC(O)(C)C)C4(C)CCC(O)CC14O
0 references
Identifiers
InChI
InChI=1S/C27H44O6/c1-16(21(29)9-10-23(2,3)31)18-8-13-26(32)20-14-22(30)27(33)15-17(28)6-11-25(27,5)19(20)7-12-24(18,26)4/h14,16-19,21,28-29,31-33H,6-13,15H2,1-5H3
0 references
InChIKey
JPYQEJHOBNSQLC-UHFFFAOYSA-N
0 references
PubChem CID
73834061
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
JPYQEJHOBNSQLC-UHFFFAOYSA-N
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