1-[(2R,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl(pyridin-4-ylmethyl)amino]methyl]-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-3-(1-naphthalenyl)urea

Properties Image MNX_ID MNXM339307 reference chebi:126169 formula C34H39N5O4 global charge 0 mol weight 581.717 InChIKey QYOWCAGNJDGPGP-XNSHOJTPSA-N InChI InChI=1S/C34H39N5O4/c1-23-19-39(24(2)22-40)33(41)18-27-17-28(36-34(42)37-30-10-6-8-26-7-4-5-9-29(26)30)11-12-31(27)43-32(23)21-38(3)20-25-13-15-35-16-14-25/h4-17,23-24,32,40H,18-22H2,1-3H3,(H2,36,37,42)/t23-,24+,32-/m0/s1 SMILES C[C@H](CO)N1C[C@H](C)[C@H](CN(C)CC2=CC=NC=C2)OC2=C(C=C(NC(=O)NC3=CC=CC4=CC=CC=C43)C=C2)CC1=O MNX internals InChI (mnx) InChI=1/C34H39N5O4/c1-23-19-39(24(2)22-40)33(41)18-27-17-28(36-34(42)37-30-10-6-8-26-7-4-5-9-29(26)30)11-12-31(27)43-32(23)21-38(3)20-25-13-15-35-16-14-25/h4-17,23-24,32,40H,18-22H2,1-3H3,(H2,36,37,42)/t23-,24+,32-/m0/s1 SMILES (mnx) [CH3:1][C@H:23]1[CH2:19][N:39]([C@H:24]([CH3:2])[CH2:22][OH:40])[C:33](=[O:41])[CH2:18][C:27]2=[C:31]([CH:12]=[CH:11][C:28]([NH:36][C:34](=[N:37][C:30]3=[CH:10][CH:6]=[CH:8][C:26]4=[CH:7][CH:4]=[CH:5][CH:9]=[C:29]43)[OH:42])=[CH:17]2)[O:43][C@H:32]1[CH2:21][N:38]([CH3:3])[CH2:20][C:25]1=[CH:14][CH:16]=[N:35][CH:15]=[CH:13]1

Parent-child relations graph

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