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

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ChEBI Name 17β-hydroxy-5α-androst-1-en-3-one propionate
ChEBI ID CHEBI:79775
ChEBI ASCII Name 17beta-hydroxy-5alpha-androst-1-en-3-one propionate
Definition An androstanoid that is (5α)-androst-1-en-17β-yl propanoate substituted by an oxo group at position 3.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C22H32O3
Net Charge 0
Average Mass 344.48770
Monoisotopic Mass 344.23514
InChI InChI=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
InChIKey YGMDGLJSAVHRSV-GRPBBMKTSA-N
SMILES CCC(=O)O[C@H]1CC[C@H]2[C@@H]3CC[C@H]4CC(=O)C=C[C@]4(C)[C@H]3CC[C@]12C
ChEBI Ontology
Outgoing 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 Xref Database
C15273 KEGG COMPOUND
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Last Modified
11 March 2015