CHEBI:16524 - testosterone acetate

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ChEBI Name testosterone acetate ChEBI ID CHEBI:16524 Definition An androstanoid that is the acetate derivative of testosterone. Stars This entity has been manually annotated by the ChEBI Team. Secondary ChEBI IDs CHEBI:15215, CHEBI:26884, CHEBI:9462 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 C21H30O3 Net Charge 0 Average Mass 330.46110 Monoisotopic Mass 330.21949 InChI InChI=1S/C21H30O3/c1-13(22)24-19-7-6-17-16-5-4-14-12-15(23)8-10-20(14,2)18(16)9-11-21(17,19)3/h12,16-19H,4-11H2,1-3H3/t16-,17-,18-,19-,20-,21-/m0/s1 InChIKey DJPZSBANTAQNFN-PXQJOHHUSA-N SMILES [H][C@@]12CCC3=CC(=O)CC[C@]3(C)[C@@]1([H])CC[C@]1(C)[C@H](CC[C@@]21[H])OC(C)=O Metabolite of Species Details Homo sapiens (NCBI:txid9606) See: PubMed Roles Classification Biological Role(s): human metabolite Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens). View more via ChEBI Ontology ChEBI Ontology Outgoing testosterone acetate (CHEBI:16524) has functional parent testosterone (CHEBI:17347) testosterone acetate (CHEBI:16524) has role human metabolite (CHEBI:77746) testosterone acetate (CHEBI:16524) is a 3-oxo-Δ4 steroid (CHEBI:47909) testosterone acetate (CHEBI:16524) is a androstanoid (CHEBI:50402) testosterone acetate (CHEBI:16524) is a sterol ester (CHEBI:35915) IUPAC Name 3-oxoandrost-4-en-17β-yl acetate Synonyms Sources 17β-acetoxy-4-androsten-3-one NIST Chemistry WebBook 17β-acetoxy-Δ4-androstan-3-one NIST Chemistry WebBook 17β-hydroxyandrost-4-en-3-one acetate NIST Chemistry WebBook testosterone 17-acetate ChemIDplus Testosterone acetate KEGG COMPOUND testosterone acetate UniProt Manual Xrefs Databases C03027 KEGG COMPOUND CPD-271 MetaCyc LMST02020057 LIPID MAPS View more database links Registry Numbers Types Sources 1045-69-8 CAS Registry Number KEGG COMPOUND 1045-69-8 CAS Registry Number ChemIDplus 1045-69-8 CAS Registry Number NIST Chemistry WebBook 2062555 Reaxys Registry Number Reaxys 2062555 Beilstein Registry Number Beilstein 969611 Gmelin Registry Number Gmelin Citations Types Sources 15625768 PubMed citation Europe PMC 21742131 PubMed citation Europe PMC 24713476 PubMed citation Europe PMC Last Modified 13 November 2017