CHEBI:108861 - 4-[[[(2R,3R)-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 Name 4-[[[(2R,3R)-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 ID CHEBI:108861 Stars This entity has been manually annotated by a third party. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C32H37FN4O6 Net Charge 0 Average Mass 592.659 Monoisotopic Mass 592.26971 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+/m1/s1 InChIKey KTBFUFCVUDUHMK-RLCGNTSFSA-N SMILES C[C@@H]1CN(C(=O)CC2=C(C=CC(=C2)NC(=O)NC3=CC=C(C=C3)F)O[C@H]1CN(C)CC4=CC=C(C=C4)C(=O)O)[C@H](C)CO ChEBI Ontology Outgoing 4-[[[(2R,3R)-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:108861) is a ureas (CHEBI:47857) Manual Xref Database LSM-20260 LINCS View more database links