(3S)-Hydrangenol 8-O-glucoside pentaacetate

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For Research Use Only.

Category

Coumarins

Cat.No.

NP1145

CAS

113270-99-8

Product Name

(3S)-Hydrangenol 8-O-glucoside pentaacetate

Structure

Product Details

Description

(3S)-Hydrangenol 8-O-glucoside pentaacetate isolated from the herbs of Hydrangea macrophylla.

Synonyms

4-{(3S)-1-Oxo-8-[(2,3,4,6-tetra-O-acetyl-β-D-glucopyranosyl)oxy]- 3,4-dihydro-1H-isochromen-3-yl}phenyl acetate

IUPAC Name

[(2R,3R,4S,5R,6S)-3,4,5-triacetyloxy-6-[[(3S)-3-(4-acetyloxyphenyl)-1-oxo-3,4-dihydroisochromen-8-yl]oxy]oxan-2-yl]methyl acetate

Molecular Weight

628.6

Molecular Formula

C31H32O14

Canonical SMILES

CC(=O)OCC1C(C(C(C(O1)OC2=CC=CC3=C2C(=O)OC(C3)C4=CC=C(C=C4)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C

InChI

InChI=1S/C31H32O14/c1-15(32)38-14-25-27(40-17(3)34)28(41-18(4)35)29(42-19(5)36)31(45-25)44-23-8-6-7-21-13-24(43-30(37)26(21)23)20-9-11-22(12-10-20)39-16(2)33/h6-12,24-25,27-29,31H,13-14H2,1-5H3/t24-,25+,27+,28-,29+,31+/m0/s1

Purity

> 95%

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