ML309 (CHEBI:232356)

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CHEBI:232356 - ML309

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ChEBI ID	CHEBI:232356
ChEBI Name	ML309
Stars
Submitter	FlyBase
Downloads	Molfile

Formula	C29H29FN4O2
Net Charge	0
Average Mass	484.575
Monoisotopic Mass	484.22745
SMILES	Cc1ccccc1C(/C(O)=N/C1CCCC1)N(C(=O)Cn1cnc2ccccc21)c1cccc(F)c1
InChI	InChI=1S/C29H29FN4O2/c1-20-9-2-5-14-24(20)28(29(36)32-22-11-3-4-12-22)34(23-13-8-10-21(30)17-23)27(35)18-33-19-31-25-15-6-7-16-26(25)33/h2,5-10,13-17,19,22,28H,3-4,11-12,18H2,1H3,(H,32,36)
InChIKey	GZLNOSRHZLTDMT-UHFFFAOYSA-N

ChEBI Ontology

Outgoing Relation(s)
	ML309 (CHEBI:232356) is a EC 1.1.1.42 (isocitrate dehydrogenase) inhibitor (CHEBI:145410)

IUPAC Name
2-(N-[2-(benzimidazol-1-yl)acetyl]-3-fluoroanilino)-N-cyclopentyl-2-(2-methylphenyl)acetamide

Citations