input word = C00049004

Metabolite InformationStructural formula
Name Methyl nonanoate
Formula C10H20O2
Mw 172.14632988
CAS RN 1731-84-6
C_ID C00049004 ,
InChIKey IJXHLVMUNBOGRR-UHFFFAOYSA-N
InChICode InChI=1S/C10H20O2/c1-3-4-5-6-7-8-9-10(11)12-2/h3-9H2,1-2H3
SMILES COC(=O)CCCCCCCC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCannabaceaeHumulus lupulus Ref.
PlantaeOleaceaeOlea europaea Ref.
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OrganismHumulus lupulus
ReferenceYan, D. et al., Food Chem., 275, (2019), 15-23.