CHEBI:125773 - 1-[(2R,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[(4-phenylphenyl)methyl]amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-3-propan-2-ylurea

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

ChEBI Name 1-[(2R,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[(4-phenylphenyl)methyl]amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-3-propan-2-ylurea ChEBI ID CHEBI:125773 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 C33H42N4O4 Net Charge 0 Average Mass 558.712 Monoisotopic Mass 558.32061 InChI InChI=1S/C33H42N4O4/c1-22(2)34-33(40)35-28-15-16-30-29(17-28)32(39)37(24(4)21-38)18-23(3)31(41-30)20-36(5)19-25-11-13-27(14-12-25)26-9-7-6-8-10-26/h6-17,22-24,31,38H,18-21H2,1-5H3,(H2,34,35,40)/t23-,24+,31-/m0/s1 InChIKey KRCYYDXJFSFYMC-JLELKNTQSA-N SMILES C[C@H]1CN(C(=O)C2=C(C=CC(=C2)NC(=O)NC(C)C)O[C@H]1CN(C)CC3=CC=C(C=C3)C4=CC=CC=C4)[C@H](C)CO ChEBI Ontology Outgoing 1-[(2R,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[(4-phenylphenyl)methyl]amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-3-propan-2-ylurea (CHEBI:125773) is a biphenyls (CHEBI:22888) Manual Xref Database LSM-37342 LINCS View more database links