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(Q82655930)
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English
(2alpha,3alpha,8xi,9xi,14xi)-2,3-Epoxyandrostan-17-one
group of stereoisomers with the chemical formula C₁₉H₂₈O₂
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
0 references
mass
288.208930136
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₉H₂₈O₂
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
CC12CCC3C(CCC4CC5OC5CC43C)C1CCC2=O
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
C[C@]12C[C@H]3O[C@H]3CC1CCC1C2CC[C@]2(C)C(=O)CCC12
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C19H28O2/c1-18-8-7-14-12(13(18)5-6-17(18)20)4-3-11-9-15-16(21-15)10-19(11,14)2/h11-16H,3-10H2,1-2H3/t11?,12?,13?,14?,15-,16+,18-,19-/m0/s1
0 references
InChIKey
WPLCXMVUVAWRQC-CCPYCNQISA-N
0 references
CAS Registry Number
965-67-3
0 references
PubChem CID
56604928
1 reference
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
UniChem compound ID
57745526
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID70717850
0 references
DSSTOX compound identifier
DTXCID30668596
0 references
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