(6S,7R,8R)-8-(hydroxymethyl)-7-[4-(3-methoxyphenyl)phenyl]-4-[oxo(3-pyridinyl)methyl]-1,4-diazabicyclo[4.2.0]octan-2-one

Properties Image MNX_ID MNXM173199 reference chebi:129757 formula C26H25N3O4 global charge 0 mol weight 443.503 InChIKey REQXYHQUJXPQQP-GIFXNVAJSA-N InChI InChI=1S/C26H25N3O4/c1-33-21-6-2-4-19(12-21)17-7-9-18(10-8-17)25-22-14-28(15-24(31)29(22)23(25)16-30)26(32)20-5-3-11-27-13-20/h2-13,22-23,25,30H,14-16H2,1H3/t22-,23+,25-/m1/s1 SMILES COC1=CC=CC(C2=CC=C([C@@H]3[C@H]4CN(C(=O)C5=CN=CC=C5)CC(=O)N4[C@H]3CO)C=C2)=C1 MNX internals InChI (mnx) InChI=1/C26H25N3O4/c1-33-21-6-2-4-19(12-21)17-7-9-18(10-8-17)25-22-14-28(15-24(31)29(22)23(25)16-30)26(32)20-5-3-11-27-13-20/h2-13,22-23,25,30H,14-16H2,1H3/t22-,23+,25-/m1/s1 SMILES (mnx) [CH3:1][O:33][C:21]1=[CH:6][CH:2]=[CH:4][C:19]([C:17]2=[CH:8][CH:10]=[C:18]([C@@H:25]3[C@H:22]4[CH2:14][N:28]([C:26]([C:20]5=[CH:13][N:27]=[CH:11][CH:3]=[CH:5]5)=[O:32])[CH2:15][C:24](=[O:31])[N:29]4[C@H:23]3[CH2:16][OH:30])[CH:9]=[CH:7]2)=[CH:12]1

Parent-child relations graph

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