1-[(4S,7R,8R)-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-phenylurea

Properties Image MNX_ID MNXM340431 reference chebi:115761 formula C24H32N4O4 global charge 0 mol weight 440.544 InChIKey VMZAIKVTLMIHQJ-JLHGSKIFSA-N InChI InChI=1S/C24H32N4O4/c1-16-13-25-17(2)15-32-21-11-10-19(27-24(30)26-18-8-6-5-7-9-18)12-20(21)23(29)28(3)14-22(16)31-4/h5-12,16-17,22,25H,13-15H2,1-4H3,(H2,26,27,30)/t16-,17+,22+/m1/s1 SMILES CO[C@H]1CN(C)C(=O)C2=C(C=CC(NC(=O)NC3=CC=CC=C3)=C2)OC[C@H](C)NC[C@H]1C MNX internals InChI (mnx) InChI=1/C24H32N4O4/c1-16-13-25-17(2)15-32-21-11-10-19(27-24(30)26-18-8-6-5-7-9-18)12-20(21)23(29)28(3)14-22(16)31-4/h5-12,16-17,22,25H,13-15H2,1-4H3,(H2,26,27,30)/t16-,17+,22+/m1/s1 SMILES (mnx) [CH3:1][C@@H:16]1[CH2:13][NH:25][C@@H:17]([CH3:2])[CH2:15][O:32][C:21]2=[C:20]([CH:12]=[C:19]([NH:27][C:24](=[N:26][C:18]3=[CH:8][CH:6]=[CH:5][CH:7]=[CH:9]3)[OH:30])[CH:10]=[CH:11]2)[C:23](=[O:29])[N:28]([CH3:3])[CH2:14][C@@H:22]1[O:31][CH3:4]

Parent-child relations graph

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