input word = C00057027

Metabolite InformationStructural formula
Name Panaquinquecol 1
Formula C18H28O3
Mw 292.20384476
CAS RN 133921-57-0
C_ID C00057027
InChIKey QSLYECSTHSYXDL-UHFFFAOYSA-N
InChICode InChI=1S/C18H28O3/c1-4-6-7-8-12-15-18(21-3)17(20)14-11-9-10-13-16(19)5-2/h5,16-20H,2,4,6-8,12,14-15H2,1,3H3
SMILES C=CC(O)C#CC#CCC(O)C(CCCCCCC)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAraliaceaePanax quinquefolium Ref.
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OrganismPanax quinquefolium
ReferenceMatsunaga, H. et al., Chem. Pharm. Bull., 1989, 37, 1279 (isol, uv, pmr, cmr, synth)