CHEBI:180657 - 3-amino-2,4-dihydroxybenzoate

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ChEBI Name 3-amino-2,4-dihydroxybenzoate
ChEBI ID CHEBI:180657
Definition An aminobenzoate that is the conjugate base of 3-amino-2,4-dihydroxybenzoic acid arising from the deprotonation of the carboxy group; major species at pH 7.3.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Kristian Axelsen
Supplier Information
Download Molfile XML SDF
Formula C7H6NO4
Net Charge -1
Average Mass 168.129
Monoisotopic Mass 168.03023
InChI InChI=1S/C7H7NO4/c8-5-4(9)2-1-3(6(5)10)7(11)12/h1-2,9-10H,8H2,(H,11,12)/p-1
InChIKey GBAYSGRTRJSJIK-UHFFFAOYSA-M
SMILES NC1=C(O)C=CC(C([O-])=O)=C1O
ChEBI Ontology
Outgoing 3-amino-2,4-dihydroxybenzoate (CHEBI:180657) is a aminobenzoate (CHEBI:22494)
3-amino-2,4-dihydroxybenzoate (CHEBI:180657) is a dihydroxybenzoate (CHEBI:36084)
3-amino-2,4-dihydroxybenzoate (CHEBI:180657) is conjugate base of 3-amino-2,4-dihydroxybenzoic acid (CHEBI:184386)
Incoming 3-amino-2,4-dihydroxybenzoic acid (CHEBI:184386) is conjugate acid of 3-amino-2,4-dihydroxybenzoate (CHEBI:180657)
IUPAC Name
3-amino-2,4-dihydroxybenzoate
Synonyms Sources
2,4-dihydroxy-3-aminobenzoate ChEBI
3-amino-2,4-dihydroxybenzoate UniProt
Manual Xref Database
CPD-23563 MetaCyc
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Citations Waiting for Citations Types Sources
26278892 PubMed citation SUBMITTER
29915173 PubMed citation Europe PMC
Last Modified
30 November 2021