1-cyclohexyl-3-[(4S,7R,8R)-8-methoxy-4,5,7,10-tetramethyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]urea

Properties Image MNX_ID MNXM344694 reference chebi:111888 formula C25H40N4O4 global charge 0 mol weight 460.619 InChIKey ZWOJFBYNCHARNU-STSQHVNTSA-N InChI InChI=1S/C25H40N4O4/c1-17-14-28(3)18(2)16-33-22-12-11-20(27-25(31)26-19-9-7-6-8-10-19)13-21(22)24(30)29(4)15-23(17)32-5/h11-13,17-19,23H,6-10,14-16H2,1-5H3,(H2,26,27,31)/t17-,18+,23+/m1/s1 SMILES CO[C@H]1CN(C)C(=O)C2=C(C=CC(NC(=O)NC3CCCCC3)=C2)OC[C@H](C)N(C)C[C@H]1C MNX internals InChI (mnx) InChI=1/C25H40N4O4/c1-17-14-28(3)18(2)16-33-22-12-11-20(27-25(31)26-19-9-7-6-8-10-19)13-21(22)24(30)29(4)15-23(17)32-5/h11-13,17-19,23H,6-10,14-16H2,1-5H3,(H2,26,27,31)/t17-,18+,23+/m1/s1 SMILES (mnx) [CH3:1][C@@H:17]1[CH2:14][N:28]([CH3:3])[C@@H:18]([CH3:2])[CH2:16][O:33][C:22]2=[C:21]([CH:13]=[C:20]([NH:27][C:25](=[N:26][CH:19]3[CH2:9][CH2:7][CH2:6][CH2:8][CH2:10]3)[OH:31])[CH:11]=[CH:12]2)[C:24](=[O:30])[N:29]([CH3:4])[CH2:15][C@@H:23]1[O:32][CH3:5]

Parent-child relations graph

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