1,5-Dicaffeoylquinic acid

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Names

[ Name ]:
1,5-Dicaffeoylquinic acid

[Synonym ]:
Listrocol
Acido,1,4-dicaffeilchinico
(1R,3R,4S,5R)-1,3-Bis{[(2E)-3-(3,4-dihydroxyphenyl)-2-propenoyl]oxy}-4,5-dihydroxycyclohexanecarboxylic acid
[1R-(1a,3a,4a,5b)]-1,3-Bis[[3-(3,4-dihydroxyphenyl)-1-oxo-2-propenyl]oxy]-4,5-dihydroxycyclohexanecarboxylic Acid
1,5-Dicaffeoylquinic acid
1,3-DICAFFEOYLQUINIC ACID
1,3-O-Dicaffeoylquinic acid
(1R,3R,4S,5R)-1,3-Bis{[(2E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy}-4,5-dihydroxycyclohexanecarboxylic acid
1-Carboxy-4,5-dihydroxy-1,3-cyclohexylenebis-(3,4-dihydroxycinnamate)
3,4-Dihydroxycinnamic Acid 1-Carboxy-4,5-dihydroxy-1,3-cyclohexylene Ester
CINARINE
1,4-Dicaffeylquinic acid
MFCD00075714
Caffeic Acid 1-Carboxy-4,5-dihydroxy-1,3-cyclohexylene Ester
Cinarcaf
Cyclohexanecarboxylic acid, 1,3-bis[[(2E)-3-(3,4-dihydroxyphenyl)-1-oxo-2-propen-1-yl]oxy]-4,5-dihydroxy-, (1R,3R,4S,5R)-
1,5-Dicaffeylquinic Acid
Cynarine
Cynara scolymus L,
Quinic Acid 1,5-Dicaffeic Ester
Plemocil
Cynarin
CINARAN
EINECS 214-655-7
Dicaffeoylquinic Acid, 1,3-

Chemical & Physical Properties

[ Density]:
1.6±0.1 g/cm3

[ Boiling Point ]:
819.9±65.0 °C at 760 mmHg

[ Melting Point ]:
225-227 °C

[ Molecular Formula ]:
C₂₅H₂₄O₁₂

[ Molecular Weight ]:
516.451

[ Flash Point ]:
278.1±27.8 °C

[ Exact Mass ]:
516.126770

[ PSA ]:
211.28000

[ LogP ]:
1.64

[ Vapour Pressure ]:
0.0±3.1 mmHg at 25°C

[ Index of Refraction ]:
1.719

[ Storage condition ]:
2-8°C

Safety Information

[ RIDADR ]:
NONH for all modes of transport

[ HS Code ]:
2932999099

Customs

[ HS Code ]: 2932999099

[ Summary ]:
2932999099. other heterocyclic compounds with oxygen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

Articles

Cheminformatics analysis of assertions mined from literature that describe drug-induced liver injury in different species.

Chem. Res. Toxicol. 23 , 171-83, (2010)

Drug-induced liver injury is one of the main causes of drug attrition. The ability to predict the liver effects of drug candidates from their chemical structures is critical to help guide experimental...

Quantitative structure-activity relationship and complex network approach to monoamine oxidase A and B inhibitors.

J. Med. Chem. 51 , 6740-51, (2008)

The work provides a new model for the prediction of the MAO-A and -B inhibitor activity by the use of combined complex networks and QSAR methodologies. On the basis of the obtained model, we prepared ...

Natural product inhibitors of protein-protein interactions mediated by Src-family SH2 domains.

Bioorg. Med. Chem. Lett. 19 , 3305-9, (2009)

In this Letter, we report the natural products salvianolic acid A, salvianolic acid B, and caftaric acid as inhibitors of the protein-protein interactions mediated by the SH2 domains of the Src-family...

1,5-Dicaffeoylquinic acid
1,5-dicaffeoylquinic acid
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