input word = C00035643

Metabolite InformationStructural formula
Name Hexyl caprylate
Formula C14H28O2
Mw 228.20893014
CAS RN 1117-55-1
C_ID C00035643 ,
InChIKey PBGWNXWNCSSXCO-UHFFFAOYSA-N
InChICode InChI=1S/C14H28O2/c1-3-5-7-9-10-12-14(15)16-13-11-8-6-4-2/h3-13H2,1-2H3
SMILES CCCCCCOC(=O)CCCCCCC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeSolanaceaeMandragora autumnalis Ref.
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