input word = C00057028

Metabolite InformationStructural formula
Name 1-(3-Heptyl-2-oxiranyl)-7-octene-2,4-diyne-1,6-diol
Panaquinquecol 2
Formula C17H24O3
Mw 276.17254463
CAS RN 133921-58-1
C_ID C00057028
InChIKey UJQVRPFUQYYCTH-UHFFFAOYSA-N
InChICode InChI=1S/C17H24O3/c1-3-5-6-7-8-13-16-17(20-16)15(19)12-10-9-11-14(18)4-2/h4,14-19H,2-3,5-8,13H2,1H3
SMILES C=CC(O)C#CC#CC(O)C1OC1CCCCCCC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAraliaceaePanax notoginseng Ref.
PlantaeAraliaceaePanax quinquefolium Ref.
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OrganismPanax quinquefolium
ReferenceBohlmann, F. et al., Chem. Ber., 1961, 94, 958

3189

1967, 100, 3450

3454

1971, 104, 2033

1975, 108, 511 (isol, derivs)