(6R,7S,8R)-4-[(2-fluorophenyl)-oxomethyl]-8-(hydroxymethyl)-7-[4-(2-phenylethynyl)phenyl]-1,4-diazabicyclo[4.2.0]octan-2-one

Properties Image MNX_ID MNXM173023 reference chebi:129377 formula C28H23FN2O3 global charge 0 mol weight 454.501 InChIKey JVSILEAOSOYGNI-KLJDGLGGSA-N InChI InChI=1S/C28H23FN2O3/c29-23-9-5-4-8-22(23)28(34)30-16-24-27(25(18-32)31(24)26(33)17-30)21-14-12-20(13-15-21)11-10-19-6-2-1-3-7-19/h1-9,12-15,24-25,27,32H,16-18H2/t24-,25-,27-/m0/s1 SMILES O=C(C1=CC=CC=C1F)N1CC(=O)N2[C@@H](CO)[C@@H](C3=CC=C(C#CC4=CC=CC=C4)C=C3)[C@@H]2C1 MNX internals InChI (mnx) InChI=1/C28H23FN2O3/c29-23-9-5-4-8-22(23)28(34)30-16-24-27(25(18-32)31(24)26(33)17-30)21-14-12-20(13-15-21)11-10-19-6-2-1-3-7-19/h1-9,12-15,24-25,27,32H,16-18H2/t24-,25-,27-/m0/s1 SMILES (mnx) [CH:1]1=[CH:2][CH:6]=[C:19]([C:10]#[C:11][C:20]2=[CH:13][CH:15]=[C:21]([C@H:27]3[C@@H:24]4[CH2:16][N:30]([C:28]([C:22]5=[CH:8][CH:4]=[CH:5][CH:9]=[C:23]5[F:29])=[O:34])[CH2:17][C:26](=[O:33])[N:31]4[C@H:25]3[CH2:18][OH:32])[CH:14]=[CH:12]2)[CH:7]=[CH:3]1

Parent-child relations graph

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