Description
Pedatisectine F is an alkaloid isolated from the tubers of Pinellia pedatisecta Schott.
Synonyms
2-Methyl-6-(1,2,3,4-tetrahydroxybutyl)pyrazine; 1-(6-Methyl-2-pyrazinyl)-1,2,3,4-butanetetrol
IUPAC Name
1-(6-methylpyrazin-2-yl)butane-1,2,3,4-tetrol
Molecular Formula
C9H14N2O4
Canonical SMILES
CC1=CN=CC(=N1)C(C(C(CO)O)O)O
InChI
InChI=1S/C9H14N2O4/c1-5-2-10-3-6(11-5)8(14)9(15)7(13)4-12/h2-3,7-9,12-15H,4H2,1H3
InChIKey
JHZAQNFLUSEYDA-UHFFFAOYSA-N
Boiling Point
529.2±50.0°C (Predicted)
Density
1.432±0.06 g/cm3(Predicted)
pKa
12.66±0.20(Predicted)