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

Properties Image MNX_ID MNXM172972 reference chebi:127854 formula C25H22FN3O3 global charge 0 mol weight 431.467 InChIKey CSXAVIOBTDLUSY-WMTXJRDZSA-N InChI InChI=1S/C25H22FN3O3/c26-20-6-2-1-5-19(20)16-7-9-17(10-8-16)24-21-13-28(14-23(31)29(21)22(24)15-30)25(32)18-4-3-11-27-12-18/h1-12,21-22,24,30H,13-15H2/t21-,22+,24+/m0/s1 SMILES O=C(C1=CN=CC=C1)N1CC(=O)N2[C@H](CO)[C@H](C3=CC=C(C4=CC=CC=C4F)C=C3)[C@@H]2C1 MNX internals InChI (mnx) InChI=1/C25H22FN3O3/c26-20-6-2-1-5-19(20)16-7-9-17(10-8-16)24-21-13-28(14-23(31)29(21)22(24)15-30)25(32)18-4-3-11-27-12-18/h1-12,21-22,24,30H,13-15H2/t21-,22+,24+/m0/s1 SMILES (mnx) [CH:1]1=[CH:2][CH:6]=[C:20]([F:26])[C:19]([C:16]2=[CH:8][CH:10]=[C:17]([C@@H:24]3[C@@H:21]4[CH2:13][N:28]([C:25]([C:18]5=[CH:12][N:27]=[CH:11][CH:3]=[CH:4]5)=[O:32])[CH2:14][C:23](=[O:31])[N:29]4[C@@H:22]3[CH2:15][OH:30])[CH:9]=[CH:7]2)=[CH:5]1

Parent-child relations graph

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