input word = C00056596

Metabolite InformationStructural formula
Name Isofalcarinolone
Formula C17H22O2
Mw 258.16197995
CAS RN 1194042-03-9
C_ID C00056596
InChIKey OFFKZGZDTWRKNW-GXDHUFHOSA-N
InChICode InChI=1S/C17H22O2/c1-3-5-6-7-8-9-10-14-17(19)15-12-11-13-16(18)4-2/h4,10,14,16,18H,2-3,5-9H2,1H3/b14-10+
SMILES C=CC(O)C#CC#CC(=O)/C=C/CCCCCCC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApiaceaeDaucus carota Ref.
zoom in



OrganismDaucus carota
ReferenceSchmiech, L. et al., J. Agric. Food Chem., 2009, 57, 11030-11040 (Isofalcarinolone)