1-cyclohexyl-3-[(4S,7R,8S)-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]urea

Properties Image MNX_ID MNXM344696 reference chebi:106623 formula C28H44N4O4 global charge 0 mol weight 500.684 InChIKey LAJHXMOWUUWHRC-BVFVYWQFSA-N InChI InChI=1S/C28H44N4O4/c1-19-15-32(16-21-10-11-21)20(2)18-36-25-13-12-23(30-28(34)29-22-8-6-5-7-9-22)14-24(25)27(33)31(3)17-26(19)35-4/h12-14,19-22,26H,5-11,15-18H2,1-4H3,(H2,29,30,34)/t19-,20+,26-/m1/s1 SMILES CO[C@@H]1CN(C)C(=O)C2=C(C=CC(NC(=O)NC3CCCCC3)=C2)OC[C@H](C)N(CC2CC2)C[C@H]1C MNX internals InChI (mnx) InChI=1/C28H44N4O4/c1-19-15-32(16-21-10-11-21)20(2)18-36-25-13-12-23(30-28(34)29-22-8-6-5-7-9-22)14-24(25)27(33)31(3)17-26(19)35-4/h12-14,19-22,26H,5-11,15-18H2,1-4H3,(H2,29,30,34)/t19-,20+,26-/m1/s1 SMILES (mnx) [CH3:1][C@@H:19]1[CH2:15][N:32]([CH2:16][CH:21]2[CH2:10][CH2:11]2)[C@@H:20]([CH3:2])[CH2:18][O:36][C:25]2=[C:24]([CH:14]=[C:23]([NH:30][C:28](=[N:29][CH:22]3[CH2:8][CH2:6][CH2:5][CH2:7][CH2:9]3)[OH:34])[CH:12]=[CH:13]2)[C:27](=[O:33])[N:31]([CH3:3])[CH2:17][C@H:26]1[O:35][CH3:4]

Parent-child relations graph

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