CHEBI:174044 - 4-Aminobenzoyl-(beta)-alanine

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name 4-Aminobenzoyl-(beta)-alanine
ChEBI ID CHEBI:174044
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C10H12N2O3
Net Charge 0
Average Mass 208.217
Monoisotopic Mass 208.08479
InChI InChI=1S/C10H12N2O3/c11-8-3-1-7(2-4-8)10(15)12-6-5-9(13)14/h1-4H,5-6,11H2,(H,12,15)(H,13,14)
InChIKey VHAXWROFYVPXMZ-UHFFFAOYSA-N
SMILES O=C(NCCC(O)=O)C1=CC=C(N)C=C1
ChEBI Ontology
Outgoing 4-Aminobenzoyl-(beta)-alanine (CHEBI:174044) has functional parent β-amino acid (CHEBI:33706)
4-Aminobenzoyl-(beta)-alanine (CHEBI:174044) is a organonitrogen compound (CHEBI:35352)
4-Aminobenzoyl-(beta)-alanine (CHEBI:174044) is a organooxygen compound (CHEBI:36963)
IUPAC Name
3-[(4-aminobenzoyl)amino]propanoic acid
Manual Xrefs Databases
628110 ChemSpider
HMDB0060757 HMDB
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Registry Number Type Source
7377-08-4 CAS Registry Number ChemIDplus