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

Properties Image MNX_ID MNXM340494 reference chebi:104359 formula C26H38N6O4 global charge 0 mol weight 498.628 InChIKey DRUGZYWRQAVALM-JXQFQVJHSA-N InChI InChI=1S/C26H38N6O4/c1-17(2)29-26(34)30-21-7-8-23-22(9-21)25(33)31(5)14-24(35-6)18(3)12-32(19(4)15-36-23)13-20-10-27-16-28-11-20/h7-11,16-19,24H,12-15H2,1-6H3,(H2,29,30,34)/t18-,19-,24-/m0/s1 SMILES CO[C@H]1CN(C)C(=O)C2=C(C=CC(NC(=O)NC(C)C)=C2)OC[C@H](C)N(CC2=CN=CN=C2)C[C@@H]1C MNX internals InChI (mnx) InChI=1/C26H38N6O4/c1-17(2)29-26(34)30-21-7-8-23-22(9-21)25(33)31(5)14-24(35-6)18(3)12-32(19(4)15-36-23)13-20-10-27-16-28-11-20/h7-11,16-19,24H,12-15H2,1-6H3,(H2,29,30,34)/t18-,19-,24-/m0/s1 SMILES (mnx) [CH3:1][CH:17]([CH3:2])[N:29]=[C:26]([NH:30][C:21]1=[CH:9][C:22]2=[C:23]([CH:8]=[CH:7]1)[O:36][CH2:15][C@H:19]([CH3:4])[N:32]([CH2:13][C:20]1=[CH:10][N:27]=[CH:16][N:28]=[CH:11]1)[CH2:12][C@H:18]([CH3:3])[C@@H:24]([O:35][CH3:6])[CH2:14][N:31]([CH3:5])[C:25]2=[O:33])[OH:34]

Parent-child relations graph

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