Cinchoninone

Properties Image MNX_ID MNXM2991 reference chebi:80686 formula C19H20N2O global charge 0 mol weight 292.382 InChIKey AEFOLTVWSRMXMW-WTNGLUPJSA-N InChI InChI=1S/C19H20N2O/c1-2-13-12-21-10-8-14(13)11-18(21)19(22)16-7-9-20-17-6-4-3-5-15(16)17/h2-7,9,13-14,18H,1,8,10-12H2/t13?,14?,18-/m1/s1 SMILES C=C[C@@H]1CN2CCC1C[C@@H]2C(=O)C1=CC=NC2=CC=CC=C21 MNX internals InChI (mnx) InChI=1/C19H20N2O/c1-2-13-12-21-10-8-14(13)11-18(21)19(22)16-7-9-20-17-6-4-3-5-15(16)17/h2-7,9,13-14,18H,1,8,10-12H2/t13?,14?,18-/m1/s1 SMILES (mnx) [CH2:1]=[CH:2][CH:13]1[CH2:12][N:21]2[CH2:10][CH2:8][CH:14]1[CH2:11][C@@H:18]2[C:19]([C:16]1=[CH:7][CH:9]=[N:20][C:17]2=[CH:6][CH:4]=[CH:3][CH:5]=[C:15]12)=[O:22]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 10 in models (compartimentalized) 0