(6R,7R,8R)-7-[4-(1-cyclopentenyl)phenyl]-4-(3-fluorophenyl)sulfonyl-8-(hydroxymethyl)-1,4-diazabicyclo[4.2.0]octan-2-one

Properties Image MNX_ID MNXM172878 reference chebi:130394 formula C24H25FN2O4S global charge 0 mol weight 456.539 InChIKey DKXZRNXCWOKGFW-WPFOTENUSA-N InChI InChI=1S/C24H25FN2O4S/c25-19-6-3-7-20(12-19)32(30,31)26-13-21-24(22(15-28)27(21)23(29)14-26)18-10-8-17(9-11-18)16-4-1-2-5-16/h3-4,6-12,21-22,24,28H,1-2,5,13-15H2/t21-,22-,24+/m0/s1 SMILES O=C1CN(S(=O)(=O)C2=CC=CC(F)=C2)C[C@H]2[C@@H](C3=CC=C(C4=CCCC4)C=C3)[C@H](CO)N12 MNX internals InChI (mnx) InChI=1/C24H25FN2O4S/c25-19-6-3-7-20(12-19)32(30,31)26-13-21-24(22(15-28)27(21)23(29)14-26)18-10-8-17(9-11-18)16-4-1-2-5-16/h3-4,6-12,21-22,24,28H,1-2,5,13-15H2/t21-,22-,24+/m0/s1 SMILES (mnx) [CH2:1]1[CH2:2][CH2:5][C:16]([C:17]2=[CH:9][CH:11]=[C:18]([C@@H:24]3[C@@H:21]4[CH2:13][N:26]([S:32]([C:20]5=[CH:7][CH:3]=[CH:6][C:19]([F:25])=[CH:12]5)(=[O:30])=[O:31])[CH2:14][C:23](=[O:29])[N:27]4[C@H:22]3[CH2:15][OH:28])[CH:10]=[CH:8]2)=[CH:4]1

Parent-child relations graph

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