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Synopsis

Synopsis

ACTIVE PHARMA INGREDIENTS

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NDC API

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Chemistry

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Also known as: Cynarin, 30964-13-7, Cinarine, 1,5-dicaffeoylquinic acid, 1,3-dicaffeoylquinic acid, Cynarine [inn]
Molecular Formula
C25H24O12
Molecular Weight
516.4  g/mol
InChI Key
YDDUMTOHNYZQPO-RVXRWRFUSA-N
FDA UNII
85D81U9JAV

Cynarin
cynarine is a natural product found in Saussurea involucrata, Helichrysum italicum, and other organisms with data available.
1 2D Structure

Cynarin

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
(1R,3R,4S,5R)-1,3-bis[[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy]-4,5-dihydroxycyclohexane-1-carboxylic acid
2.1.2 InChI
InChI=1S/C25H24O12/c26-15-5-1-13(9-17(15)28)3-7-21(31)36-20-12-25(24(34)35,11-19(30)23(20)33)37-22(32)8-4-14-2-6-16(27)18(29)10-14/h1-10,19-20,23,26-30,33H,11-12H2,(H,34,35)/b7-3+,8-4+/t19-,20-,23+,25-/m1/s1
2.1.3 InChI Key
YDDUMTOHNYZQPO-RVXRWRFUSA-N
2.1.4 Canonical SMILES
C1C(C(C(CC1(C(=O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)OC(=O)C=CC3=CC(=C(C=C3)O)O)O)O
2.1.5 Isomeric SMILES
C1[C@H]([C@@H]([C@@H](C[C@]1(C(=O)O)OC(=O)/C=C/C2=CC(=C(C=C2)O)O)OC(=O)/C=C/C3=CC(=C(C=C3)O)O)O)O
2.2 Other Identifiers
2.2.1 UNII
85D81U9JAV
2.3 Synonyms
2.3.1 MeSH Synonyms

1. 1,5-dicaffeoylquinic Acid

2. 1-carboxy-4,5-dihydroxy-1,3-cyclohexylenebis-(3,4-dihydroxycinnamate)

3. Cinarin

4. Cinarina

5. Cinarine

6. Cynarex

7. Cynarin

8. Cynarin, (1alpha,3alpha,4alpha,5beta)-isomer

9. Cynarix

10. Listricol

11. Listrocol

12. Nivellipid

13. Phemocil

2.3.2 Depositor-Supplied Synonyms

1. Cynarin

2. 30964-13-7

3. Cinarine

4. 1,5-dicaffeoylquinic Acid

5. 1,3-dicaffeoylquinic Acid

6. Cynarine [inn]

7. Cynarine [mi]

8. Plemocil

9. (1r,3r,4s,5r)-1,3-bis((3-(3,4-dihydroxyphenyl)acryloyl)oxy)-4,5-dihydroxycyclohexanecarboxylic Acid

10. Cynarine [mart.]

11. 212891-05-9

12. Cynarine [who-dd]

13. 1,3-dicqa

14. Chebi:520

15. 85d81u9jav

16. Cinarin

17. 1884-23-7

18. Caffeic Acid 1-carboxy-4,5-dihydroxy-1,3-cyclohexylene Ester

19. 1-carboxy-4,5-dihydroxy-1,3-cyclohexylenebis-(3,4-dihydroxycinnamate)

20. (1r,3r,4s,5r)-1,3-bis[[(e)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy]-4,5-dihydroxycyclohexane-1-carboxylic Acid

21. 1,5-di-o-caffeoylquinic Acid

22. Phemocil

23. 3,4-dihydroxycinnamic Acid 1-carboxy-4,5-dihydroxy-1,3-cyclohexylene Ester

24. 3,4-dihydroxycinnamic Acid, 1-carboxy-4,5-dihydroxy-1,3-cyclohexylene Ester

25. (1r,3r,4s,5r)-1,3-bis(((e)-3-(3,4-dihydroxyphenyl)acryloyl)oxy)-4,5-dihydroxycyclohexane-1-carboxylic Acid

26. (1r,3r,4s,5r)-1,3-bis((3-(3,4-dihydroxyphenyl)-1-oxo-2-propen-1-yl)oxy)-4,5-dihydroxycyclohexanecarboxylic Acid

27. (1r,3r,4s,5r)-1,3-bis({[(2e)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy})-4,5-dihydroxycyclohexane-1-carboxylic Acid

28. 1,3-dicaffeoylquinic Acid (constituent Of Echinacea Angustifolia Root, Echinacea Pallida Root, Echinacea Purpurea Root And Echinacea Purpurea Aerial Parts) [dsc]

29. Cyclohexanecarboxylic Acid, 1,3-bis(((2e)-3-(3,4-dihydroxyphenyl)-1-oxo-2-propen-1-yl)oxy)-4,5-dihydroxy-, (1r,3r,4s,5r)-

30. 1,5-dicaffeoylqunic Acid

31. Unii-85d81u9jav

32. Cynaricine

33. Quinic Acid 1,5-dicaffeic Ester

34. Cynarin, Analytical Standard

35. Schembl42528

36. 1_5_dihydrocaffeoylquinic_acid

37. Chembl487258

38. Dtxsid301309674

39. Bcp29379

40. Hy-n0359

41. Zinc4098728

42. Bdbm50369484

43. S3301

44. Akos015912727

45. Ac-6022

46. Cs-6280

47. As-74959

48. N2812

49. 1,3-dicaffeoylquinic Acid, >=98% (hplc)

50. A820670

51. J-003723

52. Q-100389

53. Q1763092

54. Cynarine;1,3-dicaffeoylquinic Acid;1,5-dqa;1,5-dicaffeoylquinic Acid

55. (1r,3r,4s,5r)-1,3-bis((3-(3,4-dihydroxyphenyl)acryloyl)oxy)-4,5-dihydroxycyclohexanecarboxylicacid

56. (1r,3r,4s,5r)-1,3-bis{[(2e)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy}-4,5-dihydroxycyclohexane-1-carboxylic Acid

57. (1r-(1.alpha.,3.alpha.,4.alpha.,5.beta.))-1,3-bis((3-(3,4-dihydroxyphenyl)-1-oxo-2-propenyl)oxy)-4,5-dihydroxycyclohexanecarboxylic Acid

58. (1r-(1alpha,3alpha,4alpha,5beta))-1,3-bis((3-(3,4-dihydroxyphenyl)-1-oxo-2-propenyl)oxy)-4,5-dihydroxycyclohexanecarboxylic Acid

59. 1,3beta-bis[(e)-3-(3,4-dihydroxyphenyl)acryloyloxy]-4beta,5alpha-dihydroxycyclohexane-1alpha-carboxylic Acid

60. Cyclohexanecarboxylic Acid, 1,3-bis((3-(3,4-dihydroxyphenyl)-1-oxo-2-propenyl)oxy)-4,5-dihydroxy-

61. Cyclohexanecarboxylic Acid,1,3-bis[[3-(3,4-dihydroxyphenyl)-1-oxo-2-propenyl]oxy]-4,5-dihydroxy-,(1r,3r,4s,5r)-

2.4 Create Date
2005-06-24
3 Chemical and Physical Properties
Molecular Weight 516.4 g/mol
Molecular Formula C25H24O12
XLogP31.5
Hydrogen Bond Donor Count7
Hydrogen Bond Acceptor Count12
Rotatable Bond Count9
Exact Mass516.12677620 g/mol
Monoisotopic Mass516.12677620 g/mol
Topological Polar Surface Area211 Ų
Heavy Atom Count37
Formal Charge0
Complexity887
Isotope Atom Count0
Defined Atom Stereocenter Count4
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count2
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1
4 Pharmacology and Biochemistry
4.1 MeSH Pharmacological Classification

Cholagogues and Choleretics

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.)


REF. STANDARDS & IMPURITIES

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ABOUT THIS PAGE

Cynarin Manufacturers

A Cynarin manufacturer is defined as any person or entity involved in the manufacture, preparation, processing, compounding or propagation of Cynarin, including repackagers and relabelers. The FDA regulates Cynarin manufacturers to ensure that their products comply with relevant laws and regulations and are safe and effective to use. Cynarin API Manufacturers are required to adhere to Good Manufacturing Practices (GMP) to ensure that their products are consistently manufactured to meet established quality criteria.

Cynarin Suppliers

A Cynarin supplier is an individual or a company that provides Cynarin active pharmaceutical ingredient (API) or Cynarin finished formulations upon request. The Cynarin suppliers may include Cynarin API manufacturers, exporters, distributors and traders.

Cynarin GMP

Cynarin Active pharmaceutical ingredient (API) is produced in GMP-certified manufacturing facility.

GMP stands for Good Manufacturing Practices, which is a system used in the pharmaceutical industry to make sure that goods are regularly produced and monitored in accordance with quality standards. The FDA’s current Good Manufacturing Practices requirements are referred to as cGMP or current GMP which indicates that the company follows the most recent GMP specifications. The World Health Organization (WHO) has its own set of GMP guidelines, called the WHO GMP. Different countries can also set their own guidelines for GMP like China (Chinese GMP) or the EU (EU GMP).

PharmaCompass offers a list of Cynarin GMP manufacturers, exporters & distributors, which can be sorted by USDMF, JDMF, KDMF, CEP (COS), WC, API price, and more, enabling you to easily find the right Cynarin GMP manufacturer or Cynarin GMP API supplier for your needs.

Cynarin CoA

A Cynarin CoA (Certificate of Analysis) is a formal document that attests to Cynarin's compliance with Cynarin specifications and serves as a tool for batch-level quality control.

Cynarin CoA mostly includes findings from lab analyses of a specific batch. For each Cynarin CoA document that a company creates, the USFDA specifies specific requirements, such as supplier information, material identification, transportation data, evidence of conformity and signature data.

Cynarin may be tested according to a variety of international standards, such as European Pharmacopoeia (Cynarin EP), Cynarin JP (Japanese Pharmacopeia) and the US Pharmacopoeia (Cynarin USP).

Inform the supplier about your product requirements, specifying if you need a product with particular monograph like EP (Ph. Eur.), USP, JP, BP, or any other quality. In addition, clarify whether you need hydrochloride (HCl), anhydricum, base, micronisatum or a specific level of purity. To find reputable suppliers, utilize the filters and select those certified by GMP, FDA, or any other certification as per your requirement.
For your convenience, we have listed synonyms and CAS numbers to help you find the best supplier. The use of synonyms and CAS numbers can be helpful in identifying potential suppliers, but it is crucial to note that they might not always indicate the exact same product. It is important to confirm the product details with the supplier before making a purchase to ensure that it meets your requirements.
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