Cyclohexanecarboxylicacid

Modify Date: 2024-01-02 16:15:46

Cyclohexanecarboxylicacid Structure
Cyclohexanecarboxylicacid structure
Common Name Cyclohexanecarboxylicacid
CAS Number 1241-87-8 Molecular Weight 354.309
Density 1.7±0.1 g/cm3 Boiling Point 636.2±55.0 °C at 760 mmHg
Molecular Formula C16H18O9 Melting Point N/A
MSDS N/A Flash Point 234.5±25.0 °C

 Use of Cyclohexanecarboxylicacid


1-Caffeoylquinic acid is an effective NF-κB inhibitor, shows significant binding affinity to the RH domain of p105 with Ki of 0.002 μM and binding energy of 1.50 Kcal/mol[1]. 1-Caffeoylquinic acid has anti-oxidative stress ability[2]. 1-Caffeoylquinic acid inhibits PD-1/PD-L1 interact[3].

 Names

Name 1-Caffeoylquinic acid
Synonym More Synonyms

 Cyclohexanecarboxylicacid Biological Activity

Description 1-Caffeoylquinic acid is an effective NF-κB inhibitor, shows significant binding affinity to the RH domain of p105 with Ki of 0.002 μM and binding energy of 1.50 Kcal/mol[1]. 1-Caffeoylquinic acid has anti-oxidative stress ability[2]. 1-Caffeoylquinic acid inhibits PD-1/PD-L1 interact[3].
Related Catalog
Target

Ki: 0.002 μM (1-Caffeoylquinic acid)[1]

References

[1]. Khan MK, et al. Dietary phytochemicals as potent chemotherapeutic agents against breast cancer: Inhibition of NF-κB pathway via molecular interactions in rel homology domain of its precursor protein p105. Pharmacogn Mag. 2013 Jan;9(33):51-7.

[2]. Jiang Y, et al. Caffeoylquinic acid derivatives rich extract from Gnaphalium pensylvanicum willd. Ameliorates hyperuricemia and acute gouty arthritis in animal model. BMC Complement Altern Med. 2017 Jun 17;17(1):320.

[3]. Han Y, et al. PD-1/PD-L1 inhibitor screening of caffeoylquinic acid compounds using surface plasmon resonance spectroscopy. Anal Biochem. 2018 Apr 15;547:52-56.

 Chemical & Physical Properties

Density 1.7±0.1 g/cm3
Boiling Point 636.2±55.0 °C at 760 mmHg
Molecular Formula C16H18O9
Molecular Weight 354.309
Flash Point 234.5±25.0 °C
Exact Mass 354.095093
PSA 164.75000
LogP 0.06
Vapour Pressure 0.0±2.0 mmHg at 25°C
Index of Refraction 1.690

 Synonyms

(1S,3R,4S,5R)-1-{[(2E)-3-(3,4-Dihydroxyphenyl)-2-propenoyl]oxy}-3,4,5-trihydroxycyclohexanecarboxylic acid
Cyclohexanecarboxylicacid
(1S,3R,4S,5R)-1-{[(2E)-3-(3,4-Dihydroxyphenyl)prop-2-enoyl]oxy}-3,4,5-trihydroxycyclohexanecarboxylic acid
Cyclohexanecarboxylic acid, 1-[[(2E)-3-(3,4-dihydroxyphenyl)-1-oxo-2-propen-1-yl]oxy]-3,4,5-trihydroxy-, (1α,3α,4α,5β)-
1-O-caffeoylquinic acid
1-Kaffeylchinasaeure