CHEBI:84094 - testosterone sulfate

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ChEBI Name testosterone sulfate ChEBI ID CHEBI:84094 Definition A steroid sulfate that is testosterone substituted by a sulfoxy group at position 17. 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 Formula C19H28O5S Net Charge 0 Average Mass 368.48800 Monoisotopic Mass 368.16575 InChI InChI=1S/C19H28O5S/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(24-25(21,22)23)19(15,2)10-8-16(14)18/h11,14-17H,3-10H2,1-2H3,(H,21,22,23)/t14-,15-,16-,17-,18-,19-/m0/s1 InChIKey WAQBISPOEAOCOG-DYKIIFRCSA-N SMILES C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@]34C)[C@@H]1CC[C@@H]2OS(O)(=O)=O 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 testosterone sulfate (CHEBI:84094) has role human urinary metabolite (CHEBI:84087) testosterone sulfate (CHEBI:84094) is a 3-oxo-Δ4 steroid (CHEBI:47909) testosterone sulfate (CHEBI:84094) is a androstanoid (CHEBI:50402) testosterone sulfate (CHEBI:84094) is a steroid sulfate (CHEBI:16158) testosterone sulfate (CHEBI:84094) is conjugate acid of testosterone sulfate(1−) (CHEBI:190489) Incoming testosterone sulfate(1−) (CHEBI:190489) is conjugate base of testosterone sulfate (CHEBI:84094) IUPAC Name (17β)-3-oxoandrost-4-en-17-yl hydrogen sulfate Synonym Source testosterone-17β-sulfate ChEBI Manual Xref Database HMDB0002833 HMDB View more database links Registry Numbers Types Sources 2422110 Reaxys Registry Number Reaxys 651-45-6 CAS Registry Number ChemIDplus Citations Types Sources 21849521 PubMed citation Europe PMC 3609707 PubMed citation Europe PMC Last Modified 04 May 2017