1-[(4S,7R,8S)-8-methoxy-4,5,7,10-tetramethyl-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 MNXM340456 reference chebi:106664 formula C22H36N4O4 global charge 0 mol weight 420.554 InChIKey PIHZSTWBUFPGGZ-GQIGUUNPSA-N InChI InChI=1S/C22H36N4O4/c1-14(2)23-22(28)24-17-8-9-19-18(10-17)21(27)26(6)12-20(29-7)15(3)11-25(5)16(4)13-30-19/h8-10,14-16,20H,11-13H2,1-7H3,(H2,23,24,28)/t15-,16+,20-/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(C)C[C@H]1C MNX internals InChI (mnx) InChI=1/C22H36N4O4/c1-14(2)23-22(28)24-17-8-9-19-18(10-17)21(27)26(6)12-20(29-7)15(3)11-25(5)16(4)13-30-19/h8-10,14-16,20H,11-13H2,1-7H3,(H2,23,24,28)/t15-,16+,20-/m1/s1 SMILES (mnx) [CH3:1][CH:14]([CH3:2])[N:23]=[C:22]([NH:24][C:17]1=[CH:10][C:18]2=[C:19]([CH:9]=[CH:8]1)[O:30][CH2:13][C@H:16]([CH3:4])[N:25]([CH3:5])[CH2:11][C@@H:15]([CH3:3])[C@H:20]([O:29][CH3:7])[CH2:12][N:26]([CH3:6])[C:21]2=[O:27])[OH:28]

Parent-child relations graph

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