Hydnocarpin

Catalog	BBC51419488
CAS	51419-48-8
Synonyms	(Rac)-Hydnocarpin
IUPAC Name	5,7-Dihydroxy-2-[2-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-2,3-dihydro-1,4-benzodioxin-6-yl]chromen-4-one
Molecular Weight	464.42
Molecular Formula	C25H20O9
Canonical SMILES	COC1=C(C=CC(=C1)C2C(OC3=C(O2)C=CC(=C3)C4=CC(=O)C5=C(C=C(C=C5O4)O)O)CO)O
InChI	InChI=1S/C25H20O9/c1-31-20-7-13(2-4-15(20)28)25-23(11-26)33-21-6-12(3-5-18(21)34-25)19-10-17(30)24-16(29)8-14(27)9-22(24)32-19/h2-10,23,25-29H,11H2,1H3
InChI Key	NMICSFNNFDNGEL-UHFFFAOYSA-N
Boiling Point	740.9±60.0 °C
Purity	98%
Density	1.496±0.06 g/ml
Appearance	Powder
pKa	6.49±0.40