input word = C00057495

Metabolite InformationStructural formula
Name 6-(1-Oxopentyl)-1-cyclohexene-1-carboxylic acid
Formula C12H18O3
Mw 210.12559444
CAS RN 6697-07-0
C_ID C00057495
InChIKey PHVSWPDOXIQPTN-UHFFFAOYSA-N
InChICode InChI=1S/C12H18O3/c1-2-3-8-11(13)9-6-4-5-7-10(9)12(14)15/h7,9H,2-6,8H2,1H3,(H,14,15)
SMILES CCCCC(C1CCCC=C1C(O)=O)=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApiaceaeApium graveolens Ref.
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