Lappaol A

Catalog	BBC62333088
CAS	62333-08-8
Structure
Synonyms	4-[[2,3-Dihydro-2-(4-hydroxy-3-methoxyphenyl)-3-hydroxymethyl-7-methoxybenzofuran-5-yl]methyl]-4,5-dihydro-3-[(4-hydroxy-3-methoxyphenyl)methyl]furan-2(3H)-one
IUPAC Name	4-[[2-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-7-methoxy-2,3-dihydro-1-benzofuran-5-yl]methyl]-3-[(4-hydroxy-3-methoxyphenyl)methyl]oxolan-2-one
Molecular Weight	536.58
Molecular Formula	C30H32O9
Canonical SMILES	COC1=C(C=CC(=C1)CC2C(COC2=O)CC3=CC(=C4C(=C3)C(C(O4)C5=CC(=C(C=C5)O)OC)CO)OC)O
InChI	InChI=1S/C30H32O9/c1-35-25-11-16(4-6-23(25)32)9-20-19(15-38-30(20)34)8-17-10-21-22(14-31)28(39-29(21)27(12-17)37-3)18-5-7-24(33)26(13-18)36-2/h4-7,10-13,19-20,22,28,31-33H,8-9,14-15H2,1-3H3
InChI Key	PYLYQTVVQXPBIJ-UHFFFAOYSA-N
Boiling Point	737.5±60.0 °C
Purity	98%
Density	1.326±0.06 g/ml
Appearance	Yellow crystalline powder
pKa	9.81±0.35