input word = C00040617

Metabolite InformationStructural formula
Name Valparicine
Formula C19H20N2
Mw 276.16264865
CAS RN 906348-22-9
C_ID C00040617 ,
InChIKey KFXIUXCXSKTCNK-XITMWMCHNA-N
InChICode InChI=1S/C19H20N2/c1-3-13-11-21-9-8-19-15-6-4-5-7-16(15)20-18(19)12(2)14(13)10-17(19)21/h3-7,14,17H,2,8-11H2,1H3/b13-3-/t14-,17-,19?/m0/s1
SMILES [C@@]123C(=Nc4c3cccc4)C(=C)[C@@H]3C[C@@H]1N(CC2)C/C/3=C/C
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Secologanin
Organism
Kingdom Family Species Reference
PlantaeApocynaceaeKopsia arborea Ref.
zoom in