Cynarin
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Cynarin
structure -
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CAS No:
30964-13-7
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Formula:
C25H24O12
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Chemical Name:
Cynarin
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Synonyms:
Cyclohexanecarboxylic acid,1,3-bis[[3-(3,4-dihydroxyphenyl)-1-oxo-2-propen-1-yl]oxy]-4,5-dihydroxy-,(1R,3R,4S,5R)-;Cinnamic acid,3,4-dihydroxy-,1-carboxy-4,5-dihydroxy-1,3-cyclohexylene ester;Cyclohexanecarboxylic acid,1,3-bis[[3-(3,4-dihydroxyphenyl)-1-oxo-2-propenyl]oxy]-4,5-dihydroxy-,[1R-(1α,3α,4α,5β)]-;Cynarine;Cyclohexanecarboxylic acid,1,3-bis[[3-(3,4-dihydroxyphenyl)-1-oxo-2-propenyl]oxy]-4,5-dihydroxy-,(1R,3R,4S,5R)-;(1R,3R,4S,5R)-1,3-Bis[[3-(3,4-dihydroxyphenyl)-1-oxo-2-propen-1-yl]oxy]-4,5-dihydroxycyclohexanecarboxylic acid;1,5-Dicaffeoylquinic acid;Cinarin;Cynarin;Cinarine
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CAS No:
Description
Cynarin is an antichoke agent with a variety of biological activities including antioxidant, antihistamic and antiviral activities.
Characteristics
211.28000
1.64
faint yellow to yellow
1.6±0.1 g/cm3
225-227 °C
819.9±65.0 °C at 760 mmHg
278.1±27.8 °C
1.719
methanol: soluble 5mg/mL, clear, light yellow to yellow
2-8°C
D25 -59° (c = 2 in methanol)
Drug Information
Gastrointestinal agents that stimulate the flow of bile into the duodenum (cholagogues) or stimulate the production of bile by the liver (choleretic). (See all compounds classified as Cholagogues and Choleretics.)
1,5-dicaffeoylquinic acid
Computed Properties
Molecular Weight:516.4
XLogP3:1.5
Hydrogen Bond Donor Count:7
Hydrogen Bond Acceptor Count:12
Rotatable Bond Count:9
Exact Mass:516.12677620
Monoisotopic Mass:516.12677620
Topological Polar Surface Area:211
Heavy Atom Count:37
Complexity:887
Defined Atom Stereocenter Count:4
Undefined Bond Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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