1-[(4R,7R,8R)-5-(cyclopropylmethyl)-8-methoxy-4,7,10-trimethyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-3-propan-2-ylurea

Properties Image MNX_ID MNXM340307 reference chebi:122712 formula C25H40N4O4 global charge 0 mol weight 460.619 InChIKey OBNHYLURRDQSSE-PNCHPQGNSA-N InChI InChI=1S/C25H40N4O4/c1-16(2)26-25(31)27-20-9-10-22-21(11-20)24(30)28(5)14-23(32-6)17(3)12-29(13-19-7-8-19)18(4)15-33-22/h9-11,16-19,23H,7-8,12-15H2,1-6H3,(H2,26,27,31)/t17-,18-,23+/m1/s1 SMILES CO[C@H]1CN(C)C(=O)C2=C(C=CC(NC(=O)NC(C)C)=C2)OC[C@@H](C)N(CC2CC2)C[C@H]1C MNX internals InChI (mnx) InChI=1/C25H40N4O4/c1-16(2)26-25(31)27-20-9-10-22-21(11-20)24(30)28(5)14-23(32-6)17(3)12-29(13-19-7-8-19)18(4)15-33-22/h9-11,16-19,23H,7-8,12-15H2,1-6H3,(H2,26,27,31)/t17-,18-,23+/m1/s1 SMILES (mnx) [CH3:1][CH:16]([CH3:2])[N:26]=[C:25]([NH:27][C:20]1=[CH:11][C:21]2=[C:22]([CH:10]=[CH:9]1)[O:33][CH2:15][C@@H:18]([CH3:4])[N:29]([CH2:13][CH:19]1[CH2:7][CH2:8]1)[CH2:12][C@@H:17]([CH3:3])[C@@H:23]([O:32][CH3:6])[CH2:14][N:28]([CH3:5])[C:24]2=[O:30])[OH:31]

Parent-child relations graph

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