input word = C00035911

Metabolite InformationStructural formula
Name Benzyl hexanoate
Formula C13H18O2
Mw 206.13067982
CAS RN 6938-45-0
C_ID C00035911 ,
InChIKey HRSXWUSONDBHSP-UHFFFAOYSA-N
InChICode InChI=1S/C13H18O2/c1-2-3-5-10-13(14)15-11-12-8-6-4-7-9-12/h4,6-9H,2-3,5,10-11H2,1H3
SMILES c1(COC(=O)CCCCC)ccccc1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeVerbenaceaeLippia chevalieri Ref.
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OrganismLippia chevalieri
ReferenceBassole,Phytochem.,65,(2003),209