Description
5'-Demethylaquillochin isolated from the herbs of Mallotus apelta. It has potential chemopreventive ability through induction of detoxification enzymes.
Synonyms
(2R,3R)-3-(3,4-Dihydroxy-5-methoxyphenyl)-2-(hydroxymethyl)-5-met hoxy-2,3-dihydro-9H-[1,4]dioxino[2,3-h]chromen-9-one
IUPAC Name
3-(3,4-dihydroxy-5-methoxyphenyl)-2-(hydroxymethyl)-5-methoxy-2,3-dihydropyrano[3,2-h][1,4]benzodioxin-9-one
Molecular Formula
C20H18O9
Canonical SMILES
COC1=CC(=CC(=C1O)O)C2C(OC3=C4C(=CC(=C3O2)OC)C=CC(=O)O4)CO
InChI
InChI=1S/C20H18O9/c1-25-12-7-10(5-11(22)16(12)24)17-14(8-21)27-20-18-9(3-4-15(23)28-18)6-13(26-2)19(20)29-17/h3-7,14,17,21-22,24H,8H2,1-2H3
InChIKey
ATBGMZCSYDMJJM-UHFFFAOYSA-N
Application
potential chemopreventive ability