input word = C00061690

Metabolite InformationStructural formula
Name Isosolanone
Formula C13H22O
Mw 194.16706532
CAS RN 39012-18-5
C_ID C00061690
InChIKey OECZDEARAHSSQV-UHFFFAOYSA-N
InChICode InChI=1S/C13H22O/c1-10(2)6-8-13(11(3)4)9-7-12(5)14/h6,8,11H,7,9H2,1-5H3
SMILES CC(=O)CCC(=CC=C(C)C)C(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeSolanaceaeNicotiana tabacum Ref.
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