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CHEBI:79775 - 17β-hydroxy-5α-androst-1-en-3-one propionate

ChEBI IDCHEBI:79775
ChEBI Name17β-hydroxy-5α-androst-1-en-3-one propionate
Stars
ASCII Name17beta-hydroxy-5alpha-androst-1-en-3-one propionate
DefinitionAn androstanoid that is (5α)-androst-1-en-17β-yl propanoate substituted by an oxo group at position 3.
Last Modified11 March 2015
DownloadsMolfile
FormulaC22H32O3
Net Charge0
Average Mass344.495
Monoisotopic Mass344.23514
SMILES[H][C@@]12CC[C@@]3([H])[C@]4([H])CC[C@H](OC(=O)CC)[C@@]4(C)CC[C@]3([H])[C@@]1(C)C=CC(=O)C2
InChIInChI=1S/C22H32O3/c1-4-20(24)25-19-8-7-17-16-6-5-14-13-15(23)9-11-21(14,2)18(16)10-12-22(17,19)3/h9,11,14,16-19H,4-8,10,12-13H2,1-3H3/t14-,16-,17-,18-,19-,21-,22-/m0/s1
InChIKeyYGMDGLJSAVHRSV-GRPBBMKTSA-N
ChEBI Ontology
Outgoing Relation(s)
17β-hydroxy-5α-androst-1-en-3-one propionate (CHEBI:79775) has parent hydride 5α-androstane (CHEBI:28859)
17β-hydroxy-5α-androst-1-en-3-one propionate (CHEBI:79775) is a 3-oxo-Δ1 steroid (CHEBI:20156)
17β-hydroxy-5α-androst-1-en-3-one propionate (CHEBI:79775) is a androstanoid (CHEBI:50402)
17β-hydroxy-5α-androst-1-en-3-one propionate (CHEBI:79775) is a steroid ester (CHEBI:47880)
IUPAC Name 
(5α)-3-oxoandrost-1-en-17β-yl propanoate
Manual XrefsDatabases
C15273KEGG COMPOUND