2-Oxo-4-methyl-2H-1-benzopyran-7-yl β-D-xylopyranoside

Catalog	BBC6734334
CAS	6734-33-4
Structure
Synonyms	4-Methyl-7-(β-D-xylopyranosyloxy)-2H-1-benzopyran-2-one
IUPAC Name	4-Methyl-7-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxychromen-2-one
Molecular Weight	308.28
Molecular Formula	C15H16O7
Canonical SMILES	CC1=CC(=O)OC2=C1C=CC(=C2)O[C@H]3[C@@H]([C@H]([C@@H](CO3)O)O)O
InChI	InChI=1S/C15H16O7/c1-7-4-12(17)22-11-5-8(2-3-9(7)11)21-15-14(19)13(18)10(16)6-20-15/h2-5,10,13-16,18-19H,6H2,1H3/t10-,13+,14-,15+/m1/s1
InChI Key	JWIYLOHVJDJZOQ-KAOXEZKKSA-N
Boiling Point	572.1±50.0 °C
Melting Point	223 °C
Purity	98%
Density	1.514±0.06 g/ml
Appearance	White to almost white powder
pKa	12.85±0.70
Solubility in Water	Slightly