10967/165 - QDB Compounds

QsarDB Repository

Lien, E. J.; Ren, S.; Bui, H.-H.; Wang, R. Quantitative structure-activity relationship analysis of phenolic antioxidants. Free Radic. Biol. Med. 1999, 26, 285–294.

Compound

ID:Tab4-32
Name:pelargonidin
Description:
Labels:
CAS:
InChi Code:InChI=1S/C15H10O5/c16-9-3-1-8(2-4-9)15-13(19)7-11-12(18)5-10(17)6-14(11)20-15/h1-7H,(H3-,16,17,18,19)/p+1

Properties

TEAC: Trolox equivalent antioxidant capacity i

ValueSource or prediction
1.3

experimental value

1.99

Eq15: Model for flavonoids and related phenolic compounds (Training set)