input word = C00062272

Metabolite InformationStructural formula
Name Isopulegyl acetate
Formula C12H20O2
Mw 196.14632988
CAS RN 57576-09-7
C_ID C00062272
InChIKey HLHIVJRLODSUCI-ADEWGFFLSA-N
InChICode InChI=1S/C12H20O2/c1-8(2)11-6-5-9(3)7-12(11)14-10(4)13/h9,11-12H,1,5-7H2,2-4H3/t9-,11+,12-/m1/s1
SMILES C=C(C)C1CCC(C)CC1OC(C)=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeClinopodium nepeta Ref.
PlantaeLabiataeOcimum basilicum Ref.
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