input word = C00034328

Metabolite InformationStructural formula
Name Sinapic acid methyl ester
trans-Sinapic acid methyl ester
Formula C12H14O5
Mw 238.08412356
CAS RN 42041-51-0
C_ID C00034328 ,
InChIKey JHLPYWLKSLVYOI-SNAWJCMRSA-N
InChICode InChI=1S/C12H14O5/c1-15-9-6-8(4-5-11(13)17-3)7-10(16-2)12(9)14/h4-7,14H,1-3H3/b5-4+
SMILES c1(c(cc(cc1OC)/C=C/C(=O)OC)OC)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeBrassicaceaeWasabia japonica Ref.
PlantaeCruciferaeBrassica carinata B line Ref.
PlantaeCruciferaeBrassica carinata Y line Ref.
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