input word = C00061691

Metabolite InformationStructural formula
Name Ferulylmalic acid
Formula C14H14O8
Mw 310.06886743
CAS RN 39015-76-4
C_ID C00061691
InChIKey NZLXTWAEDURRNL-UHFFFAOYSA-N
InChICode InChI=1S/C14H14O8/c1-21-10-6-8(2-4-9(10)15)3-5-13(18)22-11(14(19)20)7-12(16)17/h2-6,11,15H,7H2,1H3,(H,16,17)(H,19,20)
SMILES COc1cc(C=CC(=O)OC(CC(=O)O)C(=O)O)ccc1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeVicia faba Ref.
zoom in