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

Properties Image MNX_ID MNXM173057 reference chebi:126400 formula C24H27N3O4 global charge 0 mol weight 421.497 InChIKey WGGOFDUSRSVELN-FUDKSRODSA-N InChI InChI=1S/C24H27N3O4/c28-15-21-23(17-5-3-16(4-6-17)19-2-1-9-25-12-19)20-13-26(14-22(29)27(20)21)24(30)18-7-10-31-11-8-18/h1-6,9,12,18,20-21,23,28H,7-8,10-11,13-15H2/t20-,21-,23-/m0/s1 SMILES O=C(C1CCOCC1)N1CC(=O)N2[C@@H](CO)[C@@H](C3=CC=C(C4=CN=CC=C4)C=C3)[C@@H]2C1 MNX internals InChI (mnx) InChI=1/C24H27N3O4/c28-15-21-23(17-5-3-16(4-6-17)19-2-1-9-25-12-19)20-13-26(14-22(29)27(20)21)24(30)18-7-10-31-11-8-18/h1-6,9,12,18,20-21,23,28H,7-8,10-11,13-15H2/t20-,21-,23-/m0/s1 SMILES (mnx) [CH:1]1=[CH:2][C:19]([C:16]2=[CH:4][CH:6]=[C:17]([C@H:23]3[C@@H:20]4[CH2:13][N:26]([C:24]([CH:18]5[CH2:7][CH2:10][O:31][CH2:11][CH2:8]5)=[O:30])[CH2:14][C:22](=[O:29])[N:27]4[C@H:21]3[CH2:15][OH:28])[CH:5]=[CH:3]2)=[CH:12][N:25]=[CH:9]1

Parent-child relations graph

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