CHEBI:30804 - isophthalate(1−)

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ChEBI Name isophthalate(1−) ChEBI ID CHEBI:30804 ChEBI ASCII Name isophthalate(1-) Definition A dicarboxylic acid monoanion that is the conjugate base of isophthalic 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 C8H5O4 Net Charge -1 Average Mass 165.12290 Monoisotopic Mass 165.01933 InChI InChI=1S/C8H6O4/c9-7(10)5-2-1-3-6(4-5)8(11)12/h1-4H,(H,9,10)(H,11,12)/p-1 InChIKey QQVIHTHCMHWDBS-UHFFFAOYSA-M SMILES OC(=O)c1cccc(c1)C([O-])=O ChEBI Ontology Outgoing isophthalate(1−) (CHEBI:30804) is a dicarboxylic acid monoanion (CHEBI:35695) isophthalate(1−) (CHEBI:30804) is conjugate acid of isophthalate(2−) (CHEBI:30803) isophthalate(1−) (CHEBI:30804) is conjugate base of isophthalic acid (CHEBI:30802) Incoming isophthalic acid (CHEBI:30802) is conjugate acid of isophthalate(1−) (CHEBI:30804) isophthalate(2−) (CHEBI:30803) is conjugate base of isophthalate(1−) (CHEBI:30804) IUPAC Name 3-carboxybenzoate Synonym Source hydrogen isophthalate IUPAC Manual Xref Database CPD0-1267 MetaCyc View more database links Registry Number Type Source 1947083 Gmelin Registry Number Gmelin Last Modified 21 May 2014