1-[(2R,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-(methylaminomethyl)-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-3-(4-methoxyphenyl)urea

Properties Image MNX_ID MNXM339299 reference chebi:111792 formula C24H32N4O5 global charge 0 mol weight 456.543 InChIKey SBTJRJPUBKNDRG-DMPWYTOCSA-N InChI InChI=1S/C24H32N4O5/c1-15-13-28(16(2)14-29)23(30)20-11-18(7-10-21(20)33-22(15)12-25-3)27-24(31)26-17-5-8-19(32-4)9-6-17/h5-11,15-16,22,25,29H,12-14H2,1-4H3,(H2,26,27,31)/t15-,16+,22-/m0/s1 SMILES CNC[C@@H]1OC2=C(C=C(NC(=O)NC3=CC=C(OC)C=C3)C=C2)C(=O)N([C@H](C)CO)C[C@@H]1C MNX internals InChI (mnx) InChI=1/C24H32N4O5/c1-15-13-28(16(2)14-29)23(30)20-11-18(7-10-21(20)33-22(15)12-25-3)27-24(31)26-17-5-8-19(32-4)9-6-17/h5-11,15-16,22,25,29H,12-14H2,1-4H3,(H2,26,27,31)/t15-,16+,22-/m0/s1 SMILES (mnx) [CH3:1][C@H:15]1[CH2:13][N:28]([C@H:16]([CH3:2])[CH2:14][OH:29])[C:23](=[O:30])[C:20]2=[C:21]([CH:10]=[CH:7][C:18]([N:27]=[C:24]([NH:26][C:17]3=[CH:6][CH:9]=[C:19]([O:32][CH3:4])[CH:8]=[CH:5]3)[OH:31])=[CH:11]2)[O:33][C@H:22]1[CH2:12][NH:25][CH3:3]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0