4-[[[(2S,3S)-9-[[(4-fluoroanilino)-oxomethyl]amino]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-2-yl]methyl-methylamino]methyl]benzoic acid (CHEBI:108829)

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CHEBI:108829 - 4-[[[(2S,3S)-9-[[(4-fluoroanilino)-oxomethyl]amino]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-2-yl]methyl-methylamino]methyl]benzoic acid

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ChEBI ID	CHEBI:108829
ChEBI Name	4-[[[(2S,3S)-9-[[(4-fluoroanilino)-oxomethyl]amino]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-2-yl]methyl-methylamino]methyl]benzoic acid
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Downloads	Molfile

Formula	C32H37FN4O6
Net Charge	0
Average Mass	592.668
Monoisotopic Mass	592.26971
SMILES	C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(C(=O)O)cc2)Oc2ccc(NC(=O)Nc3ccc(F)cc3)cc2CC1=O
InChI	InChI=1S/C32H37FN4O6/c1-20-16-37(21(2)19-38)30(39)15-24-14-27(35-32(42)34-26-10-8-25(33)9-11-26)12-13-28(24)43-29(20)18-36(3)17-22-4-6-23(7-5-22)31(40)41/h4-14,20-21,29,38H,15-19H2,1-3H3,(H,40,41)(H2,34,35,42)/t20-,21+,29+/m0/s1
InChIKey	KTBFUFCVUDUHMK-BNJCFXFUSA-N

ChEBI Ontology

Outgoing Relation(s)
	4-[[[(2S,3S)-9-[[(4-fluoroanilino)-oxomethyl]amino]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-2-yl]methyl-methylamino]methyl]benzoic acid (CHEBI:108829) is a ureas (CHEBI:47857)

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LSM-20228	LINCS