CHEBI:128648 - 1-(4-fluorophenyl)-3-[(2S,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[(4-phenoxyphenyl)methyl]amino]methyl]-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]urea

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

ChEBI Name 1-(4-fluorophenyl)-3-[(2S,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[(4-phenoxyphenyl)methyl]amino]methyl]-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]urea ChEBI ID CHEBI:128648 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 C37H41FN4O5 Net Charge 0 Average Mass 640.745 Monoisotopic Mass 640.30610 InChI InChI=1S/C37H41FN4O5/c1-25-21-42(26(2)24-43)36(44)20-28-19-31(40-37(45)39-30-13-11-29(38)12-14-30)15-18-34(28)47-35(25)23-41(3)22-27-9-16-33(17-10-27)46-32-7-5-4-6-8-32/h4-19,25-26,35,43H,20-24H2,1-3H3,(H2,39,40,45)/t25-,26+,35+/m0/s1 InChIKey ZNTPGUKYHQEGJK-XLCATFGMSA-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)OC5=CC=CC=C5)[C@H](C)CO ChEBI Ontology Outgoing 1-(4-fluorophenyl)-3-[(2S,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[(4-phenoxyphenyl)methyl]amino]methyl]-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]urea (CHEBI:128648) is a aromatic ether (CHEBI:35618) Manual Xref Database LSM-40202 LINCS View more database links