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

Properties Image MNX_ID MNXM344692 reference chebi:100207 formula C32H46N4O4 global charge 0 mol weight 550.744 InChIKey ONZMGLOOFFOJCP-FVBCXUTKSA-N InChI InChI=1S/C32H46N4O4/c1-23-20-36(18-17-25-11-7-5-8-12-25)24(2)22-40-29-16-15-27(34-32(38)33-26-13-9-6-10-14-26)19-28(29)31(37)35(3)21-30(23)39-4/h5,7-8,11-12,15-16,19,23-24,26,30H,6,9-10,13-14,17-18,20-22H2,1-4H3,(H2,33,34,38)/t23-,24+,30+/m0/s1 SMILES CO[C@@H]1CN(C)C(=O)C2=C(C=CC(NC(=O)NC3CCCCC3)=C2)OC[C@@H](C)N(CCC2=CC=CC=C2)C[C@@H]1C MNX internals InChI (mnx) InChI=1/C32H46N4O4/c1-23-20-36(18-17-25-11-7-5-8-12-25)24(2)22-40-29-16-15-27(34-32(38)33-26-13-9-6-10-14-26)19-28(29)31(37)35(3)21-30(23)39-4/h5,7-8,11-12,15-16,19,23-24,26,30H,6,9-10,13-14,17-18,20-22H2,1-4H3,(H2,33,34,38)/t23-,24+,30+/m0/s1 SMILES (mnx) [CH3:1][C@H:23]1[CH2:20][N:36]([CH2:18][CH2:17][C:25]2=[CH:11][CH:7]=[CH:5][CH:8]=[CH:12]2)[C@H:24]([CH3:2])[CH2:22][O:40][C:29]2=[C:28]([CH:19]=[C:27]([NH:34][C:32](=[N:33][CH:26]3[CH2:13][CH2:9][CH2:6][CH2:10][CH2:14]3)[OH:38])[CH:15]=[CH:16]2)[C:31](=[O:37])[N:35]([CH3:3])[CH2:21][C@H:30]1[O:39][CH3:4]

Parent-child relations graph

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