input word = C00011688

Metabolite InformationStructural formula
Name 3-(Acetyloxy)-5-(1,5-dimethyl-4-hexenyl)-2-methyl-2,5-cyclohexadiene-1,4-dione
Formula C17H22O4
Mw 290.15180919
CAS RN 89913-50-8
C_ID C00011688 ,
InChIKey LEFQLCXKCLPZNO-UHFFFAOYNA-N
InChICode InChI=1S/C17H22O4/c1-10(2)7-6-8-11(3)14-9-15(19)12(4)17(16(14)20)21-13(5)18/h7,9,11H,6,8H2,1-5H3/t11-/m1/s1
SMILES C1=C(C(=O)C(=C(C1=O)C)OC(=O)C)[C@H](C)CCC=C(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeCoreopsis fasciculata Ref.
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