input word = C00025089

Metabolite InformationStructural formula
Name Gelsenicine
Humantenmine
Formula C19H22N2O3
Mw 326.16304258
CAS RN 82354-38-9
C_ID C00025089 ,
InChIKey BIGABVPVCRHEES-KROUIEGINA-N
InChICode InChI=1S/C19H22N2O3/c1-3-14-11-8-17-19(9-15(20-14)12(11)10-24-17)13-6-4-5-7-16(13)21(23-2)18(19)22/h4-7,11-12,15,17H,3,8-10H2,1-2H3/t11-,12+,15+,17-,19+/m1/s1
SMILES C1[C@@H]2[C@@H]3CO[C@H]1[C@]1(C[C@@H]3N=C2CC)c2c(N(C1=O)OC)cccc2
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Secologanin
Organism
Kingdom Family Species Reference
PlantaeGelsemiaceaeGelsemium elegans Ref.
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