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

Properties Image MNX_ID MNXM173094 reference chebi:128720 formula C18H22N2O2 global charge 0 mol weight 298.386 InChIKey BAFUBLVGEUEBCN-JZXOWHBKSA-N InChI InChI=1S/C18H22N2O2/c21-11-16-18(15-9-19-10-17(22)20(15)16)14-7-5-13(6-8-14)12-3-1-2-4-12/h3,5-8,15-16,18-19,21H,1-2,4,9-11H2/t15-,16+,18-/m0/s1 SMILES O=C1CNC[C@H]2[C@H](C3=CC=C(C4=CCCC4)C=C3)[C@@H](CO)N12 MNX internals InChI (mnx) InChI=1/C18H22N2O2/c21-11-16-18(15-9-19-10-17(22)20(15)16)14-7-5-13(6-8-14)12-3-1-2-4-12/h3,5-8,15-16,18-19,21H,1-2,4,9-11H2/t15-,16+,18-/m0/s1 SMILES (mnx) [CH2:1]1[CH2:2][CH2:4][C:12]([C:13]2=[CH:6][CH:8]=[C:14]([C@H:18]3[C@@H:15]4[CH2:9][NH:19][CH2:10][C:17](=[O:22])[N:20]4[C@@H:16]3[CH2:11][OH:21])[CH:7]=[CH:5]2)=[CH:3]1

Parent-child relations graph

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