(4S,7R)-4,7-bis(phenylmethyl)-9-oxa-1,6,12,13-tetrazabicyclo[9.2.1]tetradeca-11(14),12-dien-5-one

Properties Image MNX_ID MNXM172602 reference chebi:128568 formula C23H26N4O2 global charge 0 mol weight 390.487 InChIKey YTMMXCOCLAUKDR-NHCUHLMSSA-N InChI InChI=1S/C23H26N4O2/c28-23-20(13-18-7-3-1-4-8-18)11-12-27-15-22(25-26-27)17-29-16-21(24-23)14-19-9-5-2-6-10-19/h1-10,15,20-21H,11-14,16-17H2,(H,24,28)/t20-,21-/m1/s1 SMILES O=C1N[C@H](CC2=CC=CC=C2)COCC2=CN(CC[C@@H]1CC1=CC=CC=C1)N=N2 MNX internals InChI (mnx) InChI=1/C23H26N4O2/c28-23-20(13-18-7-3-1-4-8-18)11-12-27-15-22(25-26-27)17-29-16-21(24-23)14-19-9-5-2-6-10-19/h1-10,15,20-21H,11-14,16-17H2,(H,24,28)/t20-,21-/m1/s1 SMILES (mnx) [CH:1]1=[CH:3][CH:7]=[C:18]([CH2:13][C@H:20]2[CH2:11][CH2:12][N:27]3[CH:15]=[C:22]([CH2:17][O:29][CH2:16][C@@H:21]([CH2:14][C:19]4=[CH:9][CH:5]=[CH:2][CH:6]=[CH:10]4)[N:24]=[C:23]2[OH:28])[N:25]=[N:26]3)[CH:8]=[CH:4]1

Parent-child relations graph

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