input word = C00025909

Metabolite InformationStructural formula
Name Isomethuenine
Formula C19H22N2O
Mw 294.17321334
CAS RN 72748-32-4
C_ID C00025909 ,
InChIKey GCVROCDNUNQXAD-RKXBTPFZNA-N
InChICode InChI=1S/C19H22N2O/c1-3-12-10-21(2)11-13-8-16-14-6-4-5-7-17(14)20-19(16)18(22)9-15(12)13/h3-7,13,15,20H,8-11H2,1-2H3/b12-3-/t13-,15-/m0/s1
SMILES [C@H]12[C@@H](Cc3c(C(=O)C1)[nH]c1c3cccc1)CN(C/C/2=C/C)C
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Secologanin
Organism
Kingdom Family Species Reference
PlantaeApocynaceaeTabernaemontana coffeoides Boj. Ref.
PlantaeApocynaceaeTabernaemontana dichotoma Roxb.ex Wall Ref.
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