CHEBI:28489 - 2-chloromaleylacetic acid

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ChEBI Name 2-chloromaleylacetic acid ChEBI ID CHEBI:28489 Definition An organochlorine compound that is maleylacetic acid substituted by a chloro group at position 2. Stars This entity has been manually annotated by the ChEBI Team. Secondary ChEBI IDs CHEBI:19509, CHEBI:1045 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 C6H5ClO5 Net Charge 0 Average Mass 192.550 Monoisotopic Mass 191.98255 InChI InChI=1S/C6H5ClO5/c7-4(6(11)12)1-3(8)2-5(9)10/h1H,2H2,(H,9,10)(H,11,12)/b4-1+ InChIKey QOHGUQUQCPIROQ-DAFODLJHSA-N SMILES OC(=O)CC(=O)\C=C(\Cl)C(O)=O Roles Classification Chemical Role(s): Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid ) Biological Role(s): bacterial metabolite Any prokaryotic metabolite produced during a metabolic reaction in bacteria. View more via ChEBI Ontology ChEBI Ontology Outgoing 2-chloromaleylacetic acid (CHEBI:28489) has functional parent maleylacetic acid (CHEBI:1184) 2-chloromaleylacetic acid (CHEBI:28489) has role bacterial metabolite (CHEBI:76969) 2-chloromaleylacetic acid (CHEBI:28489) is a organochlorine compound (CHEBI:36683) 2-chloromaleylacetic acid (CHEBI:28489) is a oxo dicarboxylic acid (CHEBI:36145) 2-chloromaleylacetic acid (CHEBI:28489) is conjugate acid of 2-chloromaleylacetate (CHEBI:231622) Incoming 2-chloromaleylacetate (CHEBI:231622) is conjugate base of 2-chloromaleylacetic acid (CHEBI:28489) IUPAC Name (2E)-2-chloro-4-oxohex-2-enedioic acid Synonyms Sources (E)-2-chloro-4-oxo-2-hexenedioic acid ChEBI 2-chloro(maleyl)acetic acid ChEBI Manual Xref Database C00007488 KNApSAcK View more database links Citations Types Sources 405140 Chinese Abstracts citation Europe PMC 8526500 PubMed citation Europe PMC Last Modified 18 June 2024