input word = C00058960

Metabolite InformationStructural formula
Name 3-Phenylpropyl isobutyrate
Formula C13H18O2
Mw 206.13067982
CAS RN 103-58-2
C_ID C00058960
InChIKey VBTAKMZSMFMLGT-UHFFFAOYSA-N
InChICode InChI=1S/C13H18O2/c1-11(2)13(14)15-10-6-9-12-7-4-3-5-8-12/h3-5,7-8,11H,6,9-10H2,1-2H3
SMILES CC(C)C(=O)OCCCc1ccccc1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeChamaemelum nobile Ref.
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OrganismChamaemelum nobile
Referencehttps://doi.org/10.1080/10412905.1991.9697949