input word = C00055662

Metabolite InformationStructural formula
Name 3-Methylbutyl 2-methylpropanoate
Isoamyl isobutanoate
Formula C9H18O2
Mw 158.13067982
CAS RN 2050-01-3
C_ID C00055662
InChIKey VFTGLSWXJMRZNB-UHFFFAOYSA-N
InChICode InChI=1S/C9H18O2/c1-7(2)5-6-11-9(10)8(3)4/h7-8H,5-6H2,1-4H3
SMILES CC(C)CCOC(=O)C(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
BacteriaEnterobacteriaceaeEscherichia coli Ref.
PlantaeCannabaceaeHumulus lupulus Ref.
PlantaeMyrtaceaeAcca sellowiana Ref.
zoom in



OrganismAcca sellowiana
ReferencePeng, Y. et al., Molecules, 24, (2019), 2053.