(1S,2aR,8bR)-1-(hydroxymethyl)-N-propan-2-yl-2-(2-pyridinylmethyl)-1,2a,3,8b-tetrahydroazeto[2,3-c]quinoline-4-carboxamide

Properties Image MNX_ID MNXM169925 reference chebi:128388 formula C21H26N4O2 global charge 0 mol weight 366.465 InChIKey VLZSOFFJGXHIAQ-XUVXKRRUSA-N InChI InChI=1S/C21H26N4O2/c1-14(2)23-21(27)25-12-18-20(16-8-3-4-9-17(16)25)19(13-26)24(18)11-15-7-5-6-10-22-15/h3-10,14,18-20,26H,11-13H2,1-2H3,(H,23,27)/t18-,19+,20+/m0/s1 SMILES CC(C)NC(=O)N1C[C@H]2[C@@H](C3=CC=CC=C31)[C@@H](CO)N2CC1=CC=CC=N1 MNX internals InChI (mnx) InChI=1/C21H26N4O2/c1-14(2)23-21(27)25-12-18-20(16-8-3-4-9-17(16)25)19(13-26)24(18)11-15-7-5-6-10-22-15/h3-10,14,18-20,26H,11-13H2,1-2H3,(H,23,27)/t18-,19+,20+/m0/s1 SMILES (mnx) [CH3:1][CH:14]([CH3:2])[N:23]=[C:21]([N:25]1[CH2:12][C@H:18]2[C@@H:20]([C:16]3=[CH:8][CH:3]=[CH:4][CH:9]=[C:17]31)[C@@H:19]([CH2:13][OH:26])[N:24]2[CH2:11][C:15]1=[CH:7][CH:5]=[CH:6][CH:10]=[N:22]1)[OH:27]

Parent-child relations graph

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