input word = C00024944

Metabolite InformationStructural formula
Name Paniculadine
Formula C20H23NO3
Mw 325.16779361
CAS RN 188904-81-6
C_ID C00024944 ,
InChIKey XCWGEPNYYJGFMC-DLNAJGQCNA-N
InChICode InChI=1S/C20H23NO3/c1-9-4-18-7-20(24)16-17(2)5-10(22)6-19(16)12(18)3-11(9)14(23)13(18)15(19)21(20)8-17/h11-13,15-16,24H,1,3-8H2,2H3/t11-,12+,13+,15+,16+,17+,18+,19-,20+/m0/s1
SMILES C1[C@]2(CC(=O)C[C@]34[C@@H]2[C@@]2(C[C@@]56[C@H]3C[C@@H](C(=C)C5)C(=O)[C@@H]6[C@H]4N12)O)C
Start Substs in Alk. Biosynthesis (Prediction) L-Arg L-Asp
Organism
Kingdom Family Species Reference
PlantaeRanunculaceaeAconitum paniculatum Ref.
zoom in