input word = C00062147

Metabolite InformationStructural formula
Name 2,6,6-Trimethyl-1-cyclohexene-1-butanoic acid
Formula C13H22O2
Mw 210.16197995
CAS RN 54344-76-2
C_ID C00062147
InChIKey BGADGHSOFNIDPF-UHFFFAOYSA-N
InChICode InChI=1S/C13H22O2/c1-10-6-5-9-13(2,3)11(10)7-4-8-12(14)15/h4-9H2,1-3H3,(H,14,15)
SMILES CC1=C(CCCC(=O)O)C(C)(C)CCC1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeSolanaceaeNicotiana tabacum Ref.
zoom in