input word = C00051701

Metabolite InformationStructural formula
Name N-Methyl canadine
Formula C21H24NO4
Mw 354.17053326
CAS RN 37791-14-3
C_ID C00051701
InChIKey YNVMEWXLPDTKHG-SAGSJLKKNA-M
InChICode InChI=1S/C21H24NO4.ClH/c1-22-7-6-14-9-19-20(26-12-25-19)10-15(14)17(22)8-13-4-5-18(23-2)21(24-3)16(13)11-22;/h4-5,9-10,17H,6-8,11-12H2,1-3H3;1H/q+1;/p-1/t17-,22-;/m0./s1
SMILES COc1ccc2c(c1OC)C[N@+]1(C)CCc3cc4c(cc3[C@@H]1C2)OCO4.[Cl-]
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeHypericaceaeHypericum erectum Ref.
PlantaeRutaceaeZanthoxylum brachyacanthum Ref.
PlantaeRutaceaeZanthoxylum veneficium Ref.
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OrganismHypericum erectum
ReferenceYakhontova, et al., Khim Prir Soed, (1984), 673.

Buckingham(Executive Editor), Dictionary of Natural Products, Chapman & Hall, 1994, Vol1-7

1995, Vol8

1996, Vol9

1997, Vol10

1998, Vol11