input word = C00061661

Metabolite InformationStructural formula
Name 1,3,3-Trimethyl-7-oxabicyclo[4.1.0]heptane-2,5-dione
Formula C9H12O3
Mw 168.07864425
CAS RN 38284-11-6
C_ID C00061661
InChIKey VOFRQXZPJRQJIW-UHFFFAOYSA-N
InChICode InChI=1S/C9H12O3/c1-8(2)4-5(10)6-9(3,12-6)7(8)11/h6H,4H2,1-3H3
SMILES CC1(C)CC(=O)C2OC2(C)C1=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeSolanaceaeNicotiana tabacum Ref.
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