Po-Pro-1(2+)

Properties Image MNX_ID MNXM160314 reference chebi:52885 formula C20H27N3O global charge 2 mol weight 325.456 InChIKey VXLBFMWXLNAYSZ-UHFFFAOYSA-N InChI InChI=1S/C20H27N3O/c1-21-18-8-5-6-9-19(18)24-20(21)16-17-10-13-22(14-11-17)12-7-15-23(2,3)4/h5-6,8-11,13-14,16H,7,12,15H2,1-4H3/q+2 SMILES C[N+]1=C(C=C2C=CN(CCC[N+](C)(C)C)C=C2)OC2=C1C=CC=C2 MNX internals InChI (mnx) InChI=1/C20H27N3O/c1-21-18-8-5-6-9-19(18)24-20(21)16-17-10-13-22(14-11-17)12-7-15-23(2,3)4/h5-6,8-11,13-14,16H,7,12,15H2,1-4H3/q+2 SMILES (mnx) [CH3:1][N:21]1[C:18]2=[CH:8][CH:5]=[CH:6][CH:9]=[C:19]2[O+:24]=[C:20]1[CH:16]=[C:17]1[CH:10]=[CH:13][N:22]([CH2:12][CH2:7][CH2:15][N+:23]([CH3:2])([CH3:3])[CH3:4])[CH:14]=[CH:11]1

Parent-child relations graph

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