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English
(8xi,9xi,14xi)-Androst-16-en-3-one
group of stereoisomers with the chemical formula C₁₉H₂₈O
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
0 references
mass
272.214015516
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₉H₂₈O
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
CC12C=CCC1C1CCC3CC(=O)CCC3(C)C1CC2
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
C[C@]12CCC(=O)CC1CCC1C2CC[C@]2(C)C=CCC12
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C19H28O/c1-18-9-3-4-16(18)15-6-5-13-12-14(20)7-11-19(13,2)17(15)8-10-18/h3,9,13,15-17H,4-8,10-12H2,1-2H3/t13?,15?,16?,17?,18-,19-/m0/s1
0 references
InChIKey
HFVMLYAGWXSTQI-ZDZHTXOZSA-N
0 references
CAS Registry Number
32925-78-3
0 references
PubChem CID
56604930
1 reference
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
UniChem compound ID
68908448
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID30717851
0 references
DSSTOX compound identifier
DTXCID90668597
0 references
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