input word = C00041240

Metabolite InformationStructural formula
Name 12-Methoxytubotaiwine
Formula C21H26N2O3
Mw 354.19434271
CAS RN 123064-75-5
C_ID C00041240 ,
InChIKey WBKBNNAWNPDPHB-FSRWYBNZNA-N
InChICode InChI=1S/C21H26N2O3/c1-4-12-13-8-10-23-11-9-21(19(12)23)14-6-5-7-15(25-2)17(14)22-18(21)16(13)20(24)26-3/h5-7,12-13,19,22H,4,8-11H2,1-3H3/t12-,13+,19-,21-/m1/s1
SMILES CCC1[C@@H]2CCN3CCC4(C(=C2C(=O)OC)Nc2c(OC)cccc24)[C@@H]13
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Secologanin
Organism
Kingdom Family Species Reference
PlantaeApocynaceaeWinchia calophylla Ref.
zoom in