input word = C00050956

Metabolite InformationStructural formula
Name Isomesityl oxide
Formula C6H10O
Mw 98.07316494
CAS RN 3744-02-3
C_ID C00050956
InChIKey VADUDTKCGJKNDY-UHFFFAOYSA-N
InChICode InChI=1S/C6H10O/c1-5(2)4-6(3)7/h1,4H2,2-3H3
SMILES C=C(C)CC(C)=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApiaceaeCryptotaenia japonica Ref.
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OrganismCryptotaenia japonica
ReferenceEdited by Jiangsu New Medicinal College, Chinese Medicine Dictionary, Shanghai Science and technology Press, Shanghai, (1979)