input word = C00062456

Metabolite InformationStructural formula
Name Ethyl vanillate
Formula C10H12O4
Mw 196.07355887
CAS RN 617-05-0
C_ID C00062456
InChIKey MWAYRGBWOVHDDZ-UHFFFAOYSA-N
InChICode InChI=1S/C10H12O4/c1-3-14-10(12)7-4-5-8(11)9(6-7)13-2/h4-6,11H,3H2,1-2H3
SMILES CCOC(=O)c1ccc(O)c(OC)c1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeSolanaceaeNicotiana tabacum Ref.
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OrganismNicotiana tabacum
Referencehttps://doi.org/10.1016/j.chroma.2004.03.057