6-(β-D-Glucopyranosyloxy)-7-hydroxy-2H-1-benzopyran-2-one, 99% contains <7%H2O, 99% contains <7%H2O

cas: 531-75-9 — see every product listed under this CAS number, including other names

6-(β-D-Glucopyranosyloxy)-7-hydroxy-2H-1-benzopyran-2-one, 99% contains <7%H2O, 99% contains <7%H2O (CAS 531-75-9) is a chemical reagent available from Chemat. Available pack sizes: 5g, 25g. Offered by: Chemat.

• 2D
• 3D

Esculin is a hydroxycoumarin that is the 6-O-beta-D-glucoside of esculetin. It has a role as an antioxidant and a metabolite. It is a beta-D-glucoside and a hydroxycoumarin. It is functionally related to an esculetin.

Source: ChEBI

Identity

Molecular formula	C15H16O9
Molecular weight	340.28 g/mol
IUPAC name	7-hydroxy-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-2-one
InChIKey	XHCADAYNFIFUHF-TVKJYDDYSA-N
SMILES	C1=CC(=O)OC2=CC(=C(C=C21)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)O

Computed by PubChem (NCBI)

Synonyms: Esculin, Esculetin 6-O-glucoside, 6,7-Dihydroxycoumarin 6-glucoside, Esculetin 6-beta-D-glucoside, 6,7-Dihydroxycoumarin-6-O-glucoside, 7-Hydroxy-6-cumarinyl-glucosid, 6-(beta-D-Glucopyranosyloxy)-7-hydroxy-cumarin, 7-hydroxy-2-oxo-2H-chromen-6-yl beta-D-glucopyranoside, 2H-1-Benzopyran-2-one, 6-(beta-D-glucopyranosyloxy)-7-hydroxy-, aesculin

Isomers (same molecular formula)

6-hydroxy-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-2-one C₁₅H₁₆O₉

8-hydroxy-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-2-one C₁₅H₁₆O₉

7-hydroxy-8-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-2-one C₁₅H₁₆O₉

(2S,3S,4S,5R,6S)-6-[4-[(E)-2-carboxyethenyl]phenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid C₁₅H₁₆O₉

(2S,3S,4S,5R,6S)-6-[2-[(E)-2-carboxyethenyl]phenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid C₁₅H₁₆O₉

2-[(E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoyl]oxybutanedioic acid C₁₅H₁₆O₉

5-hydroxy-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-2-one C₁₅H₁₆O₉