Description
Dorsmanin A isolated from the herbs of Psoralea corylifolia.
Synonyms
(2E)-1-(3,4-Dihydro-5-hydroxy-2,2-dimethyl-2H-1-benzopyran-6-yl)-3-(4-hydroxyphenyl)-2-propen-1-one
IUPAC Name
(E)-1-(5-hydroxy-2,2-dimethyl-3,4-dihydrochromen-6-yl)-3-(4-hydroxyphenyl)prop-2-en-1-one
Molecular Formula
C20H20O4
Canonical SMILES
CC1(CCC2=C(O1)C=CC(=C2O)C(=O)C=CC3=CC=C(C=C3)O)C
InChI
InChI=1S/C20H20O4/c1-20(2)12-11-16-18(24-20)10-8-15(19(16)23)17(22)9-5-13-3-6-14(21)7-4-13/h3-10,21,23H,11-12H2,1-2H3/b9-5+
InChIKey
UDSAJERKQRQHJR-WEVVVXLNSA-N
Boiling Point
529.8±50.0°C (Predicted)
Density
1.233±0.06 g/cm3(Predicted)