input word = C00058948

Metabolite InformationStructural formula
Name Isophorone epoxide
Formula C9H14O2
Mw 154.09937969
CAS RN 10276-21-8
C_ID C00058948
InChIKey ROTNQFPVXVZSRL-UHFFFAOYSA-N
InChICode InChI=1S/C9H14O2/c1-8(2)4-6(10)7-9(3,5-8)11-7/h7H,4-5H2,1-3H3
SMILES CC1(C)CC(=O)C2OC2(C)C1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeSolanaceaeNicotiana tabacum Ref.
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