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CHEBI:80618 - Isoniazid pyruvate

ChEBI IDCHEBI:80618
ChEBI NameIsoniazid pyruvate
Stars
Last Modified26 March 2015
DownloadsMolfile
FormulaC9H9N3O3
Net Charge0
Average Mass207.189
Monoisotopic Mass207.06439
SMILESC/C(=N\NC(=O)c1ccncc1)C(=O)O
InChIInChI=1S/C9H9N3O3/c1-6(9(14)15)11-12-8(13)7-2-4-10-5-3-7/h2-5H,1H3,(H,12,13)(H,14,15)/b11-6+
InChIKeyZGGPNDKKJIWQJU-IZZDOVSWSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
Isoniazid pyruvate (CHEBI:80618) is a monocarboxylic acid (CHEBI:25384)
Manual XrefsDatabases
C16624KEGG COMPOUND
HMDB0060664HMDB
Registry NumbersSources
CAS:1081-50-1KEGG COMPOUND