Cas no 5127-64-0 ((+)-Gallocatechin gallate)
(+)-Gallocatechin gallate structure
Product Name:(+)-Gallocatechin gallate
CAS No:5127-64-0
MF:C22H18O11
MW:458.371727466583
CID:891417
PubChem ID:5276890
Update Time:2025-04-19
(+)-Gallocatechin gallate Chemical and Physical Properties
Names and Identifiers
-
- (-)-GALLOCATECHIN-3-GALLATE
- (-)-(2S,3R)-gallocatechin gallate
- (-)-Gallocatechin gallate
- (+)-Gallocatechin gallate
- (+)-Gallocatechin-3-o-gallate
- (+)-Gallocatechol gallate
- (2S,3R)-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-1(2H)-benzopyran-3,5,7-triol 3-(3,4,5-trihydroxybenzoate)
- Benzoic acid, 3,4,5-trihydroxy-, (2R,3S)-3,4-dihydro-5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-2H-1-benzopyran-3-yl ester
- CHEMBL126079
- Gallocatechin 3-O-gallate
- UNII-0C056
- GCG
- Gallocatechin-3-O-gallate
- Gallic acid, ester with gallocatechol
- FS-8798
- [(2R,3S)-5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)chroman-3-yl] 3,4,5-trihydroxybenzoate
- UNII-0C056HB16M
- 0C056HB16M
- Gallocatechin gallate
- SCHEMBL10198783
- Q5519120
- NS00094558
- (+)-Gallocatechin 3-O-gallate
- gallocatechin-3-gallate
- 3-Galloylgallocatechin
- GALLOCATECHIN 3-GALLATE
- [(2R,3S)-5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-chromen-3-yl] 3,4,5-trihydroxybenzoate
- (2R,3S)-5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-3-yl 3,4,5-trihydroxybenzoate
- (2R,3S)-5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-chromen-3-yl 3,4,5-trihydroxybenzoate
- 3,4,5-Trihydroxy-benzoic acid (2R,3S)-5,7-dihydroxy-2-(3,4,5-trihydroxy-phenyl)-chroman-3-yl ester
- AKOS026670211
- CHEBI:156284
- DTXSID701336201
- LMPK12020120
- Benzoic acid, 3,4,5-trihydroxy-, 3,4-dihydro-5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-2H-1-benzopyran-3-yl ester, (2R-trans)-
- 5127-64-0
- BDBM50135168
-
- Inchi： 1S/C22H18O11/c23-10-5-12(24)11-7-18(33-22(31)9-3-15(27)20(30)16(28)4-9)21(32-17(11)6-10)8-1-13(25)19(29)14(26)2-8/h1-6,18,21,23-30H,7H2/t18-,21+/m0/s1
- InChI Key： WMBWREPUVVBILR-GHTZIAJQSA-N
- SMILES： O1C2C=C(C=C(C=2C[C@@H]([C@H]1C1C=C(C(=C(C=1)O)O)O)OC(C1C=C(C(=C(C=1)O)O)O)=O)O)O
Computed Properties
- Exact Mass: 458.08491139g/mol
- Monoisotopic Mass: 458.08491139g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 8
- Hydrogen Bond Acceptor Count: 11
- Heavy Atom Count: 33
- Rotatable Bond Count: 4
- Complexity: 667
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 2
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.2
- Topological Polar Surface Area: 197?2
Experimental Properties
- Color/Form: Powder
- Density: 1.9±0.1 g/cm3
- Boiling Point: 909.1±65.0 °C at 760 mmHg
- Flash Point: 320.0±27.8 °C
- Vapor Pressure: 0.0±0.3 mmHg at 25°C
(+)-Gallocatechin gallate Security Information
- Hazard Statement： H303May be harmful if swallowed+H313Skin contact may be harmful+H333Inhalation may be harmful to the body
- Warning Statement： P264+P280+P305+P351+P338+P337+P313
- Safety Instruction： H303+H313+H333
- Storage Condition：Store at 4 ℃, better at -4 ℃
(+)-Gallocatechin gallate Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| TRC | G214800-1mg |
(+)-Gallocatechin gallate |
5127-64-0 | 1mg |
$ 230.00 | 2022-06-02 | ||
| TRC | G214800-2.5mg |
(+)-Gallocatechin gallate |
5127-64-0 | 2.5mg |
$ 350.00 | 2022-06-02 | ||
| TRC | G214800-5mg |
(+)-Gallocatechin gallate |
5127-64-0 | 5mg |
$ 745.00 | 2022-06-02 | ||
| TargetMol Chemicals | TN4094-1 mg |
Gallocatechin gallate |
5127-64-0 | 98% | 1mg |
￥ 490 | 2023-07-11 | |
| TargetMol Chemicals | TN4094-5 mg |
Gallocatechin gallate |
5127-64-0 | 98% | 5mg |
￥ 2,400 | 2023-07-11 | |
| TargetMol Chemicals | TN4094-1mg |
Gallocatechin gallate |
5127-64-0 | 1mg |
￥ 490 | 2024-07-20 | ||
| TargetMol Chemicals | TN4094-5mg |
Gallocatechin gallate |
5127-64-0 | 5mg |
￥ 2400 | 2024-07-20 | ||
| A2B Chem LLC | AG24839-5mg |
(+)-Gallocatechin Gallate |
5127-64-0 | 99% | 5mg |
$580.00 | 2024-04-19 | |
| Aaron | AR00DEZ7-5mg |
(-)-GALLOCATECHIN-3-GALLATE |
5127-64-0 | 5mg |
$382.00 | 2025-02-12 |
(+)-Gallocatechin gallate Related Literature
-
Aloke Das,K. K. Mahato,Chayan K. Nandi,Tapas Chakraborty,Shridhar R. Gadre,Nikhil A. Gokhale Phys. Chem. Chem. Phys., 2002,4, 2162-2168
-
J. Xu,T. J. Carrocci,A. A. Hoskins Chem. Commun., 2016,52, 549-552
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5. Fatty acid eutectic mixtures and derivatives from non-edible animal fat as phase change materials?Pau Gallart-Sirvent,Marc Martín,Gemma Villorbina,Mercè Balcells,Aran Solé,Luisa F. Cabeza,Ramon Canela-Garayoa RSC Adv., 2017,7, 24133-24139
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