input word = C00036408

Metabolite InformationStructural formula
Name 12-Methoxy-vellosimine
Formula C20H22N2O2
Mw 322.16812796
CAS RN 457613-94-4
C_ID C00036408 ,
InChIKey ZWYPHHJZHMMOCK-OATFSLKGNA-N
InChICode InChI=1S/C20H22N2O2/c1-3-11-9-22-16-8-14-12-5-4-6-18(24-2)20(12)21-19(14)17(22)7-13(11)15(16)10-23/h3-6,10,13,15-17,21H,7-9H2,1-2H3/b11-3-/t13-,15-,16+,17?/m1/s1
SMILES [C@@H]12[C@H]([C@H]3N([C@H](c4[nH]c5c(c4C3)cccc5OC)C1)C/C/2=C/C)C=O
Start Substs in Alk. Biosynthesis (Prediction) L-Trp L-Tyr Secologanin
Organism
Kingdom Family Species Reference
PlantaeApocynaceaeRauvolfia bahiensis Ref.
zoom in