input word = C00002114

Metabolite InformationStructural formula
Name Senaetnine
Formula C20H23NO7
Mw 389.1474521
CAS RN 64191-69-1
C_ID C00002114 ,
InChIKey NTGIQQBAUYBEBF-ZTSOJENZNA-N
InChICode InChI=1S/C20H23NO7/c1-5-13-8-11(2)20(4,28-12(3)22)19(25)26-10-14-6-7-21-16(23)9-15(17(14)21)27-18(13)24/h5-7,11,15H,8-10H2,1-4H3/b13-5-/t11-,15+,20-/m1/s1
SMILES c12n3ccc1COC(=O)[C@]([C@@H](C/C(=C\C)/C(=O)O[C@H]2CC3=O)C)(C)OC(=O)C
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeSenecio aetnensis Ref.
zoom in



OrganismSenecio aetnensis
ReferenceHarborne,Phytochemical Dictionary Second Edition,Taylor and Francis,(1999),Chapter26