input word = C00055244

Metabolite InformationStructural formula
Name 9-O-Acetylfalcarindiolone
Formula C19H26O4
Mw 318.18310932
CAS RN 1194042-06-2
C_ID C00055244
InChIKey HWYQQWILOGGLDF-XNTDXEJSSA-N
InChICode InChI=1S/C19H26O4/c1-4-6-7-8-9-10-15-19(23-16(3)20)18(22)14-12-11-13-17(21)5-2/h10,15,18-19,22H,4-9H2,1-3H3/b15-10+
SMILES CCCCCC/C=C/C(OC(C)=O)C(O)C#CC#CC(=O)CC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApiaceaeDaucus carota Ref.
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OrganismDaucus carota
ReferenceSchmiech, L. et al., J. Agric. Food Chem., 2009, 57, 11030-11040