3-(β-D-Glucopyranosyloxy)-2-hydroxybenzoic acid methyl ester

CAS	53827-68-2
Synonyms	Benzoic acid, 3-(β-D-glucopyranosyloxy)-2-hydroxy-, methyl ester
IUPAC Name	Methyl 2-hydroxy-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybenzoate
Molecular Weight	330.29
Molecular Formula	C14H18O9
Canonical SMILES	COC(=O)C1=C(C(=CC=C1)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)O
InChI	InChI=1S/C14H18O9/c1-21-13(20)6-3-2-4-7(9(6)16)22-14-12(19)11(18)10(17)8(5-15)23-14/h2-4,8,10-12,14-19H,5H2,1H3/t8-,10-,11+,12-,14-/m1/s1
InChI Key	VSTYNZNDJYVPKL-RRZLQCMWSA-N
Purity	98%
Appearance	Solid