CHEBI:36713 - 5α-androstane-3α,17β-diol

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ChEBI Name 5α-androstane-3α,17β-diol ChEBI ID CHEBI:36713 ChEBI ASCII Name 5alpha-androstane-3alpha,17beta-diol Definition The 5α-stereoisomer of androstane-3α,17β-diol. Stars This entity has been manually annotated by the ChEBI Team. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Wikipedia License Read full article at Wikipedia Formula C19H32O2 Net Charge 0 Average Mass 292.45618 Monoisotopic Mass 292.24023 InChI InChI=1S/C19H32O2/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/h12-17,20-21H,3-11H2,1-2H3/t12-,13+,14-,15-,16-,17-,18-,19-/m0/s1 InChIKey CBMYJHIOYJEBSB-KHOSGYARSA-N SMILES [H][C@@]12CC[C@@]3([H])[C@]4([H])CC[C@H](O)[C@@]4(C)CC[C@]3([H])[C@@]1(C)CC[C@@H](O)C2 Metabolite of Species Details Daphnia magna (NCBI:txid35525) See: Changes in the Metabolic Elimination Profile of Testosterone Following Exposure of the Crustacean Daphnia magna to TributyltinGerald A. LeBlanc and James B. McLachlanEcotoxicology and Environmental Safety 45, 296-303 (2000) Homo sapiens (NCBI:txid9606) See: DOI Roles Classification Biological Role(s): Daphnia magna metabolite A Daphnia metabolite produced by the species Daphnia magna. human metabolite Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens). View more via ChEBI Ontology ChEBI Ontology Outgoing 5α-androstane-3α,17β-diol (CHEBI:36713) has role Daphnia magna metabolite (CHEBI:83056) 5α-androstane-3α,17β-diol (CHEBI:36713) has role human metabolite (CHEBI:77746) 5α-androstane-3α,17β-diol (CHEBI:36713) is a androstane-3α,17β-diol (CHEBI:18011) Incoming 5α-androstane-3α,17β-diol 17-glucosiduronic acid (CHEBI:133517) has functional parent 5α-androstane-3α,17β-diol (CHEBI:36713) 5α-androstane-3α-glcosyl-17β-diol (CHEBI:83023) has functional parent 5α-androstane-3α,17β-diol (CHEBI:36713) 5α-androstane-3β,17β-diol 3-O-(β-D-glucuronide) (CHEBI:88730) has functional parent 5α-androstane-3α,17β-diol (CHEBI:36713) IUPAC Name 5α-androstane-3α,17β-diol Synonyms Sources (3α,5α,17β)-androstane-3,17-diol NIST Chemistry WebBook 3α,17β-dihydroxy-5α-androstane NIST Chemistry WebBook 5α-androstane-3α,17β-diol UniProt hombreol ChemIDplus Manual Xrefs Databases 15039 ChemSpider 3%CE%B1-Androstanediol Wikipedia HMDB0000495 HMDB LMST02020052 LIPID MAPS View more database links Registry Numbers Types Sources 1852-53-5 CAS Registry Number ChemIDplus 1852-53-5 CAS Registry Number NIST Chemistry WebBook 2694353 Beilstein Registry Number ChemIDplus Citation Type Source 11500254 PubMed citation Europe PMC Last Modified 14 September 2021