Clycosin

Catalog	BBC20575579
CAS	20575-57-9
Structure
Synonyms	7-Hydroxy-3-(3-hydroxy-4-methoxyphenyl)-4H-1-benzopyran-4-one
IUPAC Name	7-Hydroxy-3-(3-hydroxy-4-methoxyphenyl)chromen-4-one
Molecular Weight	284.26
Molecular Formula	C16H12O5
Canonical SMILES	COC1=C(C=C(C=C1)C2=COC3=C(C2=O)C=CC(=C3)O)O
InChI	InChI=1S/C16H12O5/c1-20-14-5-2-9(6-13(14)18)12-8-21-15-7-10(17)3-4-11(15)16(12)19/h2-8,17-18H,1H3
InChI Key	ZZAJQOPSWWVMBI-UHFFFAOYSA-N
Boiling Point	536.8±50.0 °C
Melting Point	245-247 °C
Purity	98%
Density	1.420±0.06 g/ml
Appearance	White powder
pKa	6.94±0.20