Shikonofuran A

CAS	85022-66-8
Synonyms	Dihydroechinofuran
IUPAC Name	[1-[5-(2,5-Dihydroxyphenyl)furan-3-yl]-4-methylpent-3-enyl] acetate
Molecular Weight	316.35
Molecular Formula	C18H20O5
Canonical SMILES	CC(=CCC(C1=COC(=C1)C2=C(C=CC(=C2)O)O)OC(=O)C)C
InChI	InChI=1S/C18H20O5/c1-11(2)4-7-17(23-12(3)19)13-8-18(22-10-13)15-9-14(20)5-6-16(15)21/h4-6,8-10,17,20-21H,7H2,1-3H3
InChI Key	IMZVJDUASUPZQK-UHFFFAOYSA-N
Boiling Point	358.4±21.0 °C
Purity	98%
Density	1.198±0.06 g/ml
pKa	9.89±0.43
Appearance	Powder