input word = C00050929

Metabolite InformationStructural formula
Name Isofagaridine
Formula C20H16NO4
Mw 334.10793301
CAS RN 149998-48-1
C_ID C00050929
InChIKey RSCIYYHIBVZXDI-UHFFFAOYSA-O
InChICode InChI=1S/C20H15NO4/c1-21-9-15-12(5-6-16(23-2)20(15)22)13-4-3-11-7-17-18(25-10-24-17)8-14(11)19(13)21/h3-9H,10H2,1-2H3/p+1
SMILES COc1ccc2c(c[n+](C)c3c4cc5c(cc4ccc23)OCO5)c1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRutaceaeZanthoxylum nitidum Ref.
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