CHEBI:137598 - 4-aminosalicylate(1−)

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ChEBI Name 4-aminosalicylate(1−) ChEBI ID CHEBI:137598 ChEBI ASCII Name 4-aminosalicylate(1-) Definition An aminobenzoate that is the conjugate base of 4-aminosalicylic acid, obtained by deprotonation of the carboxy group. Major miscrospecies at pH 7.3. Stars This entity has been manually annotated by the ChEBI Team. Submitter Anne Morgat 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 C7H6NO3 Net Charge -1 Average Mass 152.128 Monoisotopic Mass 152.03532 InChI InChI=1S/C7H7NO3/c8-4-1-2-5(7(10)11)6(9)3-4/h1-3,9H,8H2,(H,10,11)/p-1 InChIKey WUBBRNOQWQTFEX-UHFFFAOYSA-M SMILES C1=C(N)C=C(O)C(C([O-])=O)=C1 ChEBI Ontology Outgoing 4-aminosalicylate(1−) (CHEBI:137598) has functional parent salicylate (CHEBI:30762) 4-aminosalicylate(1−) (CHEBI:137598) is a aminobenzoate (CHEBI:22494) 4-aminosalicylate(1−) (CHEBI:137598) is a hydroxybenzoate (CHEBI:24675) 4-aminosalicylate(1−) (CHEBI:137598) is conjugate base of 4-aminosalicylic acid (CHEBI:27565) Incoming 4-aminosalicylic acid (CHEBI:27565) is conjugate acid of 4-aminosalicylate(1−) (CHEBI:137598) Synonym Source 4-aminosalicylate UniProt Manual Xref Database CPD-8817 MetaCyc View more database links Registry Number Type Source 3906055 Reaxys Registry Number Reaxys Citation Type Source 23118010 PubMed citation SUBMITTER Last Modified 17 August 2017