input word = C00055749

Metabolite InformationStructural formula
Name Butyl 3-methylbutyrate
Butyl isovalerate
Formula C9H18O2
Mw 158.13067982
CAS RN 109-19-3
C_ID C00055749
InChIKey AYWJSCLAAPJZEF-UHFFFAOYSA-N
InChICode InChI=1S/C9H18O2/c1-4-5-6-11-9(10)7-8(2)3/h8H,4-7H2,1-3H3
SMILES CCCCOC(=O)CC(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAnacardiaceaeMangifera indica Ref.
PlantaeAsteraceaeCentaurea atropurpurea Ref.
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