CHEBI:31069 - 2,3,5-trichloro-cis,cis-muconic acid

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ChEBI Name 2,3,5-trichloro-cis,cis-muconic acid ChEBI ID CHEBI:31069 ChEBI ASCII Name 2,3,5-trichloro-cis,cis-muconic acid 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 C6H3Cl3O4 Net Charge 0 Average Mass 245.44372 Monoisotopic Mass 243.90969 InChI InChI=1S/C6H3Cl3O4/c7-2(4(9)6(12)13)1-3(8)5(10)11/h1H,(H,10,11)(H,12,13)/b3-1+,4-2- InChIKey AHDWVTPNJCBFTN-TZFCGSKZSA-N SMILES OC(=O)C(\Cl)=C/C(Cl)=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 ) View more via ChEBI Ontology ChEBI Ontology Outgoing 2,3,5-trichloro-cis,cis-muconic acid (CHEBI:31069) has functional parent cis,cis-muconic acid (CHEBI:16508) 2,3,5-trichloro-cis,cis-muconic acid (CHEBI:31069) is a trichloromuconic acid (CHEBI:38448) 2,3,5-trichloro-cis,cis-muconic acid (CHEBI:31069) is conjugate acid of 2,3,5-trichloro-cis,cis-muconate(1−) (CHEBI:38427) Incoming 2,3,5-trichloro-cis,cis-muconate(1−) (CHEBI:38427) is conjugate base of 2,3,5-trichloro-cis,cis-muconic acid (CHEBI:31069) IUPAC Name (2Z,4E)-2,3,5-trichlorohexa-2,4-dienedioic acid Manual Xref Database C12833 KEGG COMPOUND View more database links Last Modified 08 June 2007