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CHEBI:223699 - NI15501A

ChEBI IDCHEBI:223699
ChEBI NameNI15501A
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SubmitterMetaboLights
DownloadsMolfile
FormulaC12H15N3O3
Net Charge0
Average Mass249.270
Monoisotopic Mass249.11134
SMILESCC(=O)N[C@@H](C)C(=O)Nc1ccccc1C(N)=O
InChIInChI=1S/C12H15N3O3/c1-7(14-8(2)16)12(18)15-10-6-4-3-5-9(10)11(13)17/h3-7H,1-2H3,(H2,13,17)(H,14,16)(H,15,18)/t7-/m0/s1
InChIKeyTVWVXIWYFXAZHZ-ZETCQYMHSA-N
Species of MetaboliteComponentSourceComments
Penicilliumspecies (ncbitaxon:5081) - PubMed (9630869)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
NI15501A (CHEBI:223699) is a amidobenzoic acid (CHEBI:48470)
IUPAC Name 
2-[[(2S)-2-acetamidopropanoyl]amino]benzamide
Manual XrefsDatabases
8013537ChemSpider