input word = C00002302

Metabolite InformationStructural formula
Name Scopoline
Formula C8H13NO2
Mw 155.09462867
CAS RN 487-27-4
C_ID C00002302 ,
InChIKey MEGPURSNXMUDAE-FMHCIICTNA-N
InChICode InChI=1S/C8H13NO2/c1-9-5-2-4-3-6(9)8(11-4)7(5)10/h4-8,10H,2-3H2,1H3/t4-,5-,6+,7-,8-/m0/s1
SMILES [C@H]12C[C@@H]3O[C@H]([C@H]1O)[C@@H](C3)N2C
Start Substs in Alk. Biosynthesis (Prediction) L-Pro L-Arg L-Asp
Organism
Kingdom Family Species Reference
PlantaeCruciferaeArabidopsis thaliana Ref.
PlantaeSolanaceaeSolandra grandiflora Ref.
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