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(Q83004173)
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English
19-Aminoandrost-4-ene-3,17-dione
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
androstane steroid
1 reference
based on heuristic
inferred from SMILES
mass
301.20417910400005
dalton
1 reference
based on heuristic
inferred from isomeric SMILES
chemical formula
C₁₉H₂₇NO₂
0 references
canonical SMILES
CC12CCC3C(CCC4=CC(=O)CCC43CN)C1CCC2=O
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
C[C@]12CC[C@H]3[C@H]([C@@H]1CCC2=O)CCC4=CC(=O)CC[C@]34CN
0 references
Identifiers
InChI
InChI=1S/C19H27NO2/c1-18-8-7-16-14(15(18)4-5-17(18)22)3-2-12-10-13(21)6-9-19(12,16)11-20/h10,14-16H,2-9,11,20H2,1H3/t14-,15-,16-,18-,19+/m0/s1
0 references
InChIKey
WNNJNJHARHJMJK-BGJMDTOESA-N
0 references
CAS Registry Number
87994-68-1
0 references
PubChem CID
137376
0 references
UniChem compound ID
26091361
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID801007895
1 reference
matched by identifier from
InChIKey
InChIKey
WNNJNJHARHJMJK-BGJMDTOESA-N
DSSTOX compound identifier
DTXCID001434741
0 references
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