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CHEBI:232950 - 2-(6-chloro-5,7-dimethyl-3-oxo-1,4-benzoxazin-4-yl)acetic acid

ChEBI IDCHEBI:232950
ChEBI Name2-(6-chloro-5,7-dimethyl-3-oxo-1,4-benzoxazin-4-yl)acetic acid
Stars
SubmitterFlyBase
DownloadsMolfile
FormulaC12H12ClNO4
Net Charge0
Average Mass269.684
Monoisotopic Mass269.04549
SMILESCc1cc2c(c(C)c1Cl)N(CC(=O)O)C(=O)CO2
InChIInChI=1S/C12H12ClNO4/c1-6-3-8-12(7(2)11(6)13)14(4-10(16)17)9(15)5-18-8/h3H,4-5H2,1-2H3,(H,16,17)
InChIKeySUZXIGFIHWADFB-UHFFFAOYSA-N
Roles Classification
Biological Role:
EC 1.14.13.* (oxidoreductase acting on paired donors, incorporating 1 atom of oxygen, with NADH or NADPH as one donor) inhibitor  An EC 1.14.* (oxidoreductase acting on paired donors, with incorporation or reduction of molecular oxygen) inhibitor that interferes with the action of any such enzyme incorporating one atom of oxygen and using NADH or NADPH as one donor (EC 1.14.13.*).
ChEBI Ontology
Outgoing Relation(s)
2-(6-chloro-5,7-dimethyl-3-oxo-1,4-benzoxazin-4-yl)acetic acid (CHEBI:232950) has role EC 1.14.13.* (oxidoreductase acting on paired donors, incorporating 1 atom of oxygen, with NADH or NADPH as one donor) inhibitor (CHEBI:76841)
2-(6-chloro-5,7-dimethyl-3-oxo-1,4-benzoxazin-4-yl)acetic acid (CHEBI:232950) is a organic molecular entity (CHEBI:50860)
IUPAC Name 
2-(6-chloro-5,7-dimethyl-3-oxo-1,4-benzoxazin-4-yl)acetic acid
Citations