input word = C00057460

Metabolite InformationStructural formula
Name Pseudoisoeugenol 2-methylbutanoate
Formula C15H20O3
Mw 248.1412445
CAS RN 58989-20-1
C_ID C00057460
InChIKey YARRWVYKHJNVHX-FNORWQNLSA-N
InChICode InChI=1S/C15H20O3/c1-5-7-12-10-13(17-4)8-9-14(12)18-15(16)11(3)6-2/h5,7-11H,6H2,1-4H3/b7-5+
SMILES C/C=C/C1=CC(OC)=CC=C1OC(C(CC)C)=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApiaceaePimpinella anisum Ref.
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