Corynanthine

Properties Image MNX_ID MNXM169913 reference chebi:92122 formula C21H26N2O3 global charge 0 mol weight 354.45 InChIKey BLGXFZZNTVWLAY-DKJBZYCGSA-N InChI InChI=1S/C21H26N2O3/c1-26-21(25)19-15-10-17-20-14(13-4-2-3-5-16(13)22-20)8-9-23(17)11-12(15)6-7-18(19)24/h2-5,12,15,17-19,22,24H,6-11H2,1H3/t12-,15-,17-,18-,19-/m0/s1 SMILES COC(=O)[C@H]1[C@H]2C[C@H]3C4=C(CCN3C[C@@H]2CC[C@@H]1O)C1=CC=CC=C1N4 MNX internals InChI (mnx) InChI=1/C21H26N2O3/c1-26-21(25)19-15-10-17-20-14(13-4-2-3-5-16(13)22-20)8-9-23(17)11-12(15)6-7-18(19)24/h2-5,12,15,17-19,22,24H,6-11H2,1H3/t12-,15-,17-,18-,19-/m0/s1 SMILES (mnx) [CH3:1][O:26][C:21]([C@H:19]1[C@H:15]2[CH2:10][C@H:17]3[C:20]4=[C:14]([CH2:8][CH2:9][N:23]3[CH2:11][C@@H:12]2[CH2:6][CH2:7][C@@H:18]1[OH:24])[C:13]1=[CH:4][CH:2]=[CH:3][CH:5]=[C:16]1[NH:22]4)=[O:25]

Parent-child relations graph

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