input word = C00035538

Metabolite InformationStructural formula
Name beta-Isocyclolavandulyl acetate
Formula C12H20O2
Mw 196.14632988
CAS RN 866494-88-4
C_ID C00035538 ,
InChIKey QHJKSPVTMXZZCA-UHFFFAOYNA-N
InChICode InChI=1S/C12H20O2/c1-9-7-12(3,4)6-5-11(9)8-14-10(2)13/h5,9H,6-8H2,1-4H3/t9-/m1/s1
SMILES C1C(CC=C([C@@H]1C)COC(=O)C)(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApiaceaePeucedanum paniculatum L. Ref.
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