CAS Number13405-60-2
Synonyms[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] 3,4,5-trihydroxybenzoate; 1-O-Galloyl-β-D-glucose; 1-Galloyl-beta-glucose; β-Glucogalin
Molecular FormulaC13H16O10
Molecular Weight332.26
Density1.85
Melting Point214℃
AppearanceOff-white to light gray solid
Symbol
Signal WordWarning
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 13405-60-2 |
| Catalog No. | 2A-1184490 |
| Chinese Name | 1-O-没食子酰基葡萄糖 |
| Synonyms | [(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] 3,4,5-trihydroxybenzoate; 1-O-Galloyl-β-D-glucose; 1-Galloyl-beta-glucose; β-Glucogalin |
| Molecular Formula | C13H16O10 |
| Molecular Weight | 332.26 |
| Density | 1.85 |
| Melting Point | 214℃ |
| Appearance | Off-white to light gray solid |
| Storage Condition | 20°C, inert gas |
| Application | β-Glucogallin is a potent and selective aldose reductase (AKR1B1) inhibitor. β-Glucogallin can be isolated from the medicinal plant Emblica officinalis. |
| PubChem ID | 4386 |
| MDL Number | MFCD11975493 |
| SMILES | O=C(OC1OC(CO)C(O)C(O)C1O)c1cc(O)c(O)c(O)c1 |
| InChI | InChI=1S/C13H16O10/c14-3-7-9(18)10(19)11(20)13(22-7)23-12(21)4-1-5(15)8(17)6(16)2-4/h1-2,7,9-11,13-20H,3H2/t7-,9-,10+,11-,13+/m1/s1 |
| InChI Key | GDVRUDXLQBVIKP-HQHREHCSSA-N |
| NACRES Code | NA.24 |
| UNSPSC | 41116107 |
| Hazard Symbols | transportation |
| Bioactivity | β-Glucogallin is a potent and selective aldose reductase (AKR1B1) inhibitor. β-Glucogallin can be isolated from the medicinal plant Emblica officinalis[1]. Related Catalog Signaling Pathways >> Metabolic Enzyme/Protease >> Aldose Reductase Research Areas >> Metabolic Disease References [1]. Li L, et al. Design of an amide N-glycoside derivative of β-glucogallin: a stable, potent, and specific inhibitor of aldose reductase. J Med Chem. 2014 Jan 9;57(1):71-7. Chemical & Physical Properties Density 1.85 Melting Point 214℃ Molecular Formula C13H16O10 Molecular Weight 332.26000 Exact Mass 332.07400 PSA 177.14000 Vapour Pressure 9.04E-23mmHg at 25°C InChIKey GDVRUDXLQBVIKP-HQHREHCSSA-N SMILES O=C(OC1OC(CO)C(O)C(O)C1O)c1cc(O)c(O)c(O)c1 |
| Use of | β-Glucogallin is a potent and selective aldose reductase (AKR1B1) inhibitor. β-Glucogallin can be isolated from the medicinal plant Emblica officinalis[1]. Properties Name [3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] 3,4,5-trihydroxybenzoate Synonym More Synonyms 1-Galloyl-beta-glucose Biological Activity Description β-Glucogallin is a potent and selective aldose reductase (AKR1B1) inhibitor. β-Glucogallin can be isolated from the medicinal plant Emblica officinalis[1]. Related Catalog Signaling Pathways >> Metabolic Enzyme/Protease >> Aldose Reductase Research Areas >> Metabolic Disease References [1]. Li L, et al. Design of an amide N-glycoside derivative of β-glucogallin: a stable, potent, and specific inhibitor of aldose reductase. J Med Chem. 2014 Jan 9;57(1):71-7. Chemical & Physical Properties Molecular Formula C13H16O10 Exact Mass 332.07400 PSA 177.14000 InChIKey GDVRUDXLQBVIKP-HQHREHCSSA-N |
| Transport Info | Shipping Name: UN |
| MSDS Transport Info | Module 14. Shipping information European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.2 United Nations shipping name European Land Transport Dangerous Regulations: Non-dangerous goods IMDG Code: Non-dangerous goods International air transport dangerous goods regulations: non-dangerous goods 14.3 Transport hazard categories European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.4 Package group European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.5 Environmental hazards European Land Transport Danger Regulations: No International Maritime Danger Regulations International Air Transport Danger Regulations: No Marine pollutants (yes/no): No 14.6 Special reminder to users No data available |
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