CHEBI:17468 - (4-bromophenylsulfanyl)pyruvate

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ChEBI Name (4-bromophenylsulfanyl)pyruvate ChEBI ID CHEBI:17468 Definition A 2-oxo monocarboxylic acid anion that is the conjugate base of (4-bromophenylsulfanyl)pyruvic acid, arising from deprotonation of the carboxy group. Stars This entity has been manually annotated by the ChEBI Team. Secondary ChEBI IDs CHEBI:12735, CHEBI:22016 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 C9H6BrO3S Net Charge -1 Average Mass 274.11214 Monoisotopic Mass 272.92265 InChI InChI=1S/C9H7BrO3S/c10-6-1-3-7(4-2-6)14-5-8(11)9(12)13/h1-4H,5H2,(H,12,13)/p-1 InChIKey QJDFZNIKGFGPCR-UHFFFAOYSA-M SMILES [O-]C(=O)C(=O)CSc1ccc(Br)cc1 ChEBI Ontology Outgoing (4-bromophenylsulfanyl)pyruvate (CHEBI:17468) has functional parent bromobenzene (CHEBI:3179) (4-bromophenylsulfanyl)pyruvate (CHEBI:17468) has functional parent pyruvate (CHEBI:15361) (4-bromophenylsulfanyl)pyruvate (CHEBI:17468) is a 2-oxo monocarboxylic acid anion (CHEBI:35179) (4-bromophenylsulfanyl)pyruvate (CHEBI:17468) is conjugate base of (4-bromophenylsulfanyl)pyruvic acid (CHEBI:8934) Incoming (4-bromophenylsulfanyl)pyruvic acid (CHEBI:8934) is conjugate acid of (4-bromophenylsulfanyl)pyruvate (CHEBI:17468) IUPAC Name 3-[(4-bromophenyl)sulfanyl]-2-oxopropanoate Synonyms Sources 3-((4-bromophenyl)sulfanyl)-2-oxopropanoate UniProt S-(4-Bromophenyl)-mercaptopyruvate KEGG COMPOUND S-(4-bromophenyl)sulfanylpyruvate ChEBI Manual Xref Database C04264 KEGG COMPOUND View more database links Last Modified 21 October 2020