(6S,7S,8S)-N-(2-fluorophenyl)-8-(hydroxymethyl)-7-[4-(3-methoxyprop-1-ynyl)phenyl]-2-oxo-1,4-diazabicyclo[4.2.0]octane-4-carboxamide

Properties Image MNX_ID MNXM173406 reference chebi:130603 formula C24H24FN3O4 global charge 0 mol weight 437.471 InChIKey JQIVWCFXIXDPKG-XPNTWCBSSA-N InChI InChI=1S/C24H24FN3O4/c1-32-12-4-5-16-8-10-17(11-9-16)23-20-13-27(14-22(30)28(20)21(23)15-29)24(31)26-19-7-3-2-6-18(19)25/h2-3,6-11,20-21,23,29H,12-15H2,1H3,(H,26,31)/t20-,21-,23+/m1/s1 SMILES COCC#CC1=CC=C([C@@H]2[C@@H](CO)N3C(=O)CN(C(=O)NC4=CC=CC=C4F)C[C@H]23)C=C1 MNX internals InChI (mnx) InChI=1/C24H24FN3O4/c1-32-12-4-5-16-8-10-17(11-9-16)23-20-13-27(14-22(30)28(20)21(23)15-29)24(31)26-19-7-3-2-6-18(19)25/h2-3,6-11,20-21,23,29H,12-15H2,1H3,(H,26,31)/t20-,21-,23+/m1/s1 SMILES (mnx) [CH3:1][O:32][CH2:12][C:4]#[C:5][C:16]1=[CH:9][CH:11]=[C:17]([C@H:23]2[C@H:20]3[CH2:13][N:27]([C:24](=[N:26][C:19]4=[CH:7][CH:3]=[CH:2][CH:6]=[C:18]4[F:25])[OH:31])[CH2:14][C:22](=[O:30])[N:28]3[C@@H:21]2[CH2:15][OH:29])[CH:10]=[CH:8]1

Parent-child relations graph

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