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Cynarin

Cynarin structure

Cynarin 

structure
  • CAS No:

    30964-13-7

  • Formula:

    C25H24O12

  • Chemical Name:

    Cynarin

  • 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

  • Categories:

    Biochemical Engineering  >  Plant Extracts

Description

Cynarin is an antichoke agent with a variety of biological activities including antioxidant, antihistamic and antiviral activities.

Cynarin Basic Attributes

516.45

516.45

214-655-7

DTXSID0050423

2932999099

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)

Safety Information

NONH for all modes of transport

3

24/25

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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