CHEBI:133778 - 1α-hydroxyandrost-4-ene-3,17-dione

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ChEBI Name 1α-hydroxyandrost-4-ene-3,17-dione ChEBI ID CHEBI:133778 ChEBI ASCII Name 1alpha-hydroxyandrost-4-ene-3,17-dione Definition An androstanoid that is androst-4-ene-3,17-dione in which the hydrogen at the 1α position has been replaced by a hydroxy group. Stars This entity has been manually annotated by the ChEBI Team. Submitter Anne Morgat Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C19H26O3 Net Charge 0 Average Mass 302.409 Monoisotopic Mass 302.18819 InChI InChI=1S/C19H26O3/c1-18-8-7-15-13(14(18)5-6-16(18)21)4-3-11-9-12(20)10-17(22)19(11,15)2/h9,13-15,17,22H,3-8,10H2,1-2H3/t13-,14-,15-,17-,18-,19-/m0/s1 InChIKey JVRABWKGNATXPC-HQRJMKCBSA-N SMILES [C@@H]1(CC(C=C2[C@]1([C@@]3([C@@](CC2)([C@]4([C@](CC3)(C(CC4)=O)C)[H])[H])[H])C)=O)O ChEBI Ontology Outgoing 1α-hydroxyandrost-4-ene-3,17-dione (CHEBI:133778) has functional parent androst-4-ene-3,17-dione (CHEBI:16422) 1α-hydroxyandrost-4-ene-3,17-dione (CHEBI:133778) is a 1-hydroxy steroid (CHEBI:71017) 1α-hydroxyandrost-4-ene-3,17-dione (CHEBI:133778) is a 17-oxo steroid (CHEBI:19168) 1α-hydroxyandrost-4-ene-3,17-dione (CHEBI:133778) is a 3-oxo-Δ4 steroid (CHEBI:47909) 1α-hydroxyandrost-4-ene-3,17-dione (CHEBI:133778) is a androstanoid (CHEBI:50402) IUPAC Name 1α-hydroxyandrost-4-ene-3,17-dione Synonyms Sources (1α)-1-hydroxyandrost-4-ene-3,17-dione ChEBI 1α-hydroxyandrost-4-ene-3,17-dione UniProt 1α-hydroxyandrostenedione ChEBI Manual Xref Database CPD-18924 MetaCyc View more database links Registry Number Type Source 3155094 Reaxys Registry Number Reaxys Citation Type Source 26478560 PubMed citation SUBMITTER Last Modified 03 March 2017