Cas no 123166-70-1 (1,3,4,5-Tetra-O-galloylquinic acid)
123166-70-1 structure
Product Name:1,3,4,5-Tetra-O-galloylquinic acid
CAS No:123166-70-1
MF:C35H28O22
MW:800.583632469177
CID:2037833
PubChem ID:500050
Update Time:2025-04-21
1,3,4,5-Tetra-O-galloylquinic acid Chemical and Physical Properties
Names and Identifiers
-
- 1,3,4,5-Tetra-O-galloylquinic acid
- tetragalloylquinic acid
- NSC627861
- 1,3,4,5-Tetrakis((3,4,5-trihydroxybenzoyl)oxy)cyclohexanecarboxylic acid
- 1,3,4,5-Tetragqa
- SCHEMBL17220948
- 1,3,4,5-tetrakis[(3,4,5-trihydroxybenzoyl)oxy]cyclohexanecarboxylic acid
- 1,3,4,5-TetragGQA
- 1,3,4,5-tetra(3,4,5-trihydroxyphenylcarbonyloxy)-1-cyclohexanecarboxylic acid
- NSC692278
- BDBM50469586
- Benzoic acid, 3,4,5-trihydroxy-, tetramol. ester, 5-carboxy-2,3,5-trihydroxycyclohexyl ester, (1alpha,2beta,3beta,5beta)-
- 1,3,4,5-tetrakis[(3,4,5-trihydroxybenzoyl)oxy]cyclohexane-1-carboxylic acid
- DTXSID70910965
- CHEMBL36985
- 123166-70-1
- 1,4,5-tetra-O-galloylquinic acid
- (3R,5R)-1,3,4,5-tetrakis[(3,4,5-trihydroxybenzoyl)oxy]cyclohexanecarboxylic acid
- DTXSID001295892
- NSC-692278
- 1,3,4,5 Tetra-O-Galloylquinic Acid
- 109008-79-9
-
- Inchi： 1S/C35H28O22/c36-15-1-11(2-16(37)25(15)44)30(48)54-23-9-35(34(52)53,57-33(51)14-7-21(42)28(47)22(43)8-14)10-24(55-31(49)12-3-17(38)26(45)18(39)4-12)29(23)56-32(50)13-5-19(40)27(46)20(41)6-13/h1-8,23-24,29,36-47H,9-10H2,(H,52,53)/t23-,24-,29?,35?/m1/s1
- InChI Key： JQVXKQDWMIXILH-JHZIIMIVSA-N
- SMILES： O(C(C1C=C(C(=C(C=1)O)O)O)=O)C1(C(=O)O)C[C@H](C([C@@H](C1)OC(C1C=C(C(=C(C=1)O)O)O)=O)OC(C1C=C(C(=C(C=1)O)O)O)=O)OC(C1C=C(C(=C(C=1)O)O)O)=O
Computed Properties
- Exact Mass: 800.10722252g/mol
- Monoisotopic Mass: 800.10722252g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 13
- Hydrogen Bond Acceptor Count: 22
- Heavy Atom Count: 57
- Rotatable Bond Count: 13
- Complexity: 1370
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 2
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.3
- Topological Polar Surface Area: 385?2
1,3,4,5-Tetra-O-galloylquinic acid Suppliers
NewCan Biotech Limited
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(CAS:123166-70-1)1,3,4,5-O-tetragalloylquinic acid
Order Number:NC22395
Stock Status:
Quantity:10g
Purity:97%
Pricing Information Last Updated:Friday, 18 July 2025 16:17
Price ($):Price inquiry
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1,3,4,5-Tetra-O-galloylquinic acid Related Literature
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Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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Sowmyalakshmi Venkataraman RSC Adv., 2015,5, 73807-73813
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Recommended suppliers
NewCan Biotech Limited
(CAS:123166-70-1)1,3,4,5-O-tetragalloylquinic acid
Purity:97%
Quantity:10g
Price ($):Inquiry