CHEBI:133930 - 5α-androst-1-ene-3,17-dione

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ChEBI Name 5α-androst-1-ene-3,17-dione
ChEBI ID CHEBI:133930
ChEBI ASCII Name 5alpha-androst-1-ene-3,17-dione
Definition A 3-oxo Δ1-steroid that is androst-1-ene substituted by oxo groups at positions 3 and 17.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Anne Morgat
Supplier Information
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Formula C19H26O2
Net Charge 0
Average Mass 286.409
Monoisotopic Mass 286.19328
InChI InChI=1S/C19H26O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h7,9,12,14-16H,3-6,8,10-11H2,1-2H3/t12-,14-,15-,16-,18-,19-/m0/s1
InChIKey WJIQCDPCDVWDDE-WZNAKSSCSA-N
SMILES C1C[C@@]2([C@@]([C@@]3([C@@]1(CC(C=C3)=O)[H])C)(CC[C@@]4(C(=O)CC[C@@]24[H])C)[H])[H]
Roles Classification
Biological Role(s): human urinary metabolite
Any metabolite (endogenous or exogenous) found in human urine samples.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 5α-androst-1-ene-3,17-dione (CHEBI:133930) has role human urinary metabolite (CHEBI:84087)
5α-androst-1-ene-3,17-dione (CHEBI:133930) is a 17-oxo steroid (CHEBI:19168)
5α-androst-1-ene-3,17-dione (CHEBI:133930) is a 3-oxo-Δ1 steroid (CHEBI:20156)
5α-androst-1-ene-3,17-dione (CHEBI:133930) is a androstanoid (CHEBI:50402)
IUPAC Name
5α-androst-1-ene-3,17-dione
Synonyms Sources
1-Androstenedione ChemIDplus
5α-androst-1-ene-3,17-dione ChEBI
5α-androst-1-ene-3,17-dione UniProt
delta1-5alpha-Androstene-3,17-dione ChemIDplus
Δ1-androstene-3,17-dione ChEBI
Registry Numbers Types Sources
3085323 Reaxys Registry Number Reaxys
571-40-4 CAS Registry Number ChemIDplus
Citations Waiting for Citations Types Sources
17123559 PubMed citation Europe PMC
21310167 PubMed citation Europe PMC
22350385 PubMed citation Europe PMC
23090723 PubMed citation Europe PMC
25797375 PubMed citation Europe PMC
8655514 PubMed citation SUBMITTER
Last Modified
04 November 2020