input word = C00029242

Metabolite InformationStructural formula
Name Xanthoxyline
Formula C10H11BrO4
Mw 273.98407174
CAS RN 18064-89-6
C_ID C00029242 ,
InChIKey ONBWYQYLBKAJTM-UHFFFAOYSA-N
InChICode InChI=1S/C10H11BrO4/c1-5(12)8-6(14-2)4-7(15-3)9(11)10(8)13/h4,13H,1-3H3
SMILES COc1cc(OC)c(C(C)=O)c(O)c1Br
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRutaceaeZanthoxylum rhoifolium Ref.
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