CHEBI:136639 - testosterone 17-O-(β-D-glucuronide)(1−)

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ChEBI Name testosterone 17-O-(β-D-glucuronide)(1−) ChEBI ID CHEBI:136639 ChEBI ASCII Name testosterone 17-O-(beta-D-glucuronide)(1-) Definition A steroid glucuronide anion that is the conjugate base of testosterone 17-O-(β-D-glucuronide) arising from deprotonation of the carboxylic acid function; major species at pH 7.3. Stars This entity has been manually annotated by the ChEBI Team. Submitter Nevila Nouspikel 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 C25H35O8 Net Charge -1 Average Mass 463.542 Monoisotopic Mass 463.23374 InChI InChI=1S/C25H36O8/c1-24-9-7-13(26)11-12(24)3-4-14-15-5-6-17(25(15,2)10-8-16(14)24)32-23-20(29)18(27)19(28)21(33-23)22(30)31/h11,14-21,23,27-29H,3-10H2,1-2H3,(H,30,31)/p-1/t14-,15-,16-,17-,18-,19-,20+,21-,23+,24-,25-/m0/s1 InChIKey NIKZPECGCSUSBV-HMAFJQTKSA-M SMILES [C@@]12([C@@]([C@@]3(C(CC1)=CC(CC3)=O)C)(CC[C@]4(C)[C@H](CC[C@@]24[H])O[C@@H]5O[C@@H]([C@H]([C@@H]([C@H]5O)O)O)C([O-])=O)[H])[H] ChEBI Ontology Outgoing testosterone 17-O-(β-D-glucuronide)(1−) (CHEBI:136639) is a β-D-glucosiduronate (CHEBI:83411) testosterone 17-O-(β-D-glucuronide)(1−) (CHEBI:136639) is a androstane conjugate (CHEBI:167106) testosterone 17-O-(β-D-glucuronide)(1−) (CHEBI:136639) is a steroid glucosiduronic acid anion (CHEBI:136637) testosterone 17-O-(β-D-glucuronide)(1−) (CHEBI:136639) is conjugate base of testosterone 17-glucosiduronic acid (CHEBI:28835) Incoming testosterone 17-glucosiduronic acid (CHEBI:28835) is conjugate acid of testosterone 17-O-(β-D-glucuronide)(1−) (CHEBI:136639) IUPAC Name 3-oxoandrost-4-en-17β-yl β-D-glucopyranosiduronate Synonym Source testosterone 17-O-(β-D-glucuronate) UniProt Citation Type Source 19022937 PubMed citation SUBMITTER Last Modified 21 June 2017