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Chemistry

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Also known as: Cichoric acid, L-chicoric acid, 70831-56-0, 6537-80-0, (-)-chicoric acid, Dicaffeoyltartaric acid
Molecular Formula
C22H18O12
Molecular Weight
474.4  g/mol
InChI Key
YDDGKXBLOXEEMN-IABMMNSOSA-N
FDA UNII
S4YY3V8YHD

Cichoric Acid
cichoric acid is a natural product found in Cichorium intybus, Hydrastis canadensis, and other organisms with data available.
1 2D Structure

Cichoric Acid

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
(2R,3R)-2,3-bis[[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy]butanedioic acid
2.1.2 InChI
InChI=1S/C22H18O12/c23-13-5-1-11(9-15(13)25)3-7-17(27)33-19(21(29)30)20(22(31)32)34-18(28)8-4-12-2-6-14(24)16(26)10-12/h1-10,19-20,23-26H,(H,29,30)(H,31,32)/b7-3+,8-4+/t19-,20-/m1/s1
2.1.3 InChI Key
YDDGKXBLOXEEMN-IABMMNSOSA-N
2.1.4 Canonical SMILES
C1=CC(=C(C=C1C=CC(=O)OC(C(C(=O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)C(=O)O)O)O
2.1.5 Isomeric SMILES
C1=CC(=C(C=C1/C=C/C(=O)O[C@@H](C(=O)O)[C@@H](OC(=O)/C=C/C2=CC(=C(C=C2)O)O)C(=O)O)O)O
2.2 Other Identifiers
2.2.1 UNII
S4YY3V8YHD
2.3 Synonyms
2.3.1 MeSH Synonyms

1. (-)-chicoric Acid

2. (-)-l-chicoric Acid

3. (2r,3r)-2,3-bis(((2e)-3-(3,4-dihydroxyphenyl)-1-oxo-2-propen-1-yl)oxy)-butanedioic Acid

4. Cichoric Acid

5. Dicaffeoyltartaric Acid

6. L-chicoric Acid

2.3.2 Depositor-Supplied Synonyms

1. Cichoric Acid

2. L-chicoric Acid

3. 70831-56-0

4. 6537-80-0

5. (-)-chicoric Acid

6. Dicaffeoyltartaric Acid

7. L-cichoric Acid

8. (2r,3r)-2,3-bis[[(e)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy]butanedioic Acid

9. (-)-l-chicoric Acid

10. Nsc 699173

11. L-dcta

12. Chicoric Acid, (-)-

13. Nsc699173

14. S4yy3v8yhd

15. Dicaffeoyl-l-tartaric Acid

16. Trans-caffeoyltartaric Acid

17. Chebi:3594

18. Chembl282731

19. 2,3-bis((3-(3,4-dihydroxyphenyl)-1-oxo-2-propenyl)oxy)butanedioic Acid

20. (r-(r*,r*-(e,e)))-2,3-bis((3-(3,4-dihydroxphenyl)-1-oxo-2-propenyl)oxy)butanedioic Acid

21. Nsc-699173

22. (2r,3r)-2,3-bis(((e)-3-(3,4-dihydroxyphenyl)acryloyl)oxy)succinic Acid

23. (2r,3r)-2,3-bis[[(e)-3-(3,4-dihydroxyphenyl)acryloyl]oxy]succinic Acid

24. Chicoricacid

25. (2r,3r)-2,3-bis{[(2e)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy}butanedioic Acid

26. Butanedioic Acid, 2,3-bis[[(2e)-3-(3,4-dihydroxyphenyl)-1-oxo-2-propenyl]oxy]-, (2r,3r)-

27. Unii-s4yy3v8yhd

28. L-chicoricacid

29. 1-chicoricacid

30. Cichoric-acid

31. L-chicoric-acid

32. Gkp

33. ( ?)-chicoric Acid

34. Ech Purpurea Pe

35. Echinacea Purpurea Powder

36. L-ca

37. Ech Angustifolia Pe

38. Dsstox_cid_13332

39. Dsstox_rid_79064

40. Dsstox_gsid_33332

41. Echinacea Purpurea Root Extract

42. Chicoric Acid [usp-rs]

43. Dtxsid0033332

44. Schembl15532218

45. Chicoric Acid, >=95% (hplc)

46. Hy-n0457

47. Zinc4098726

48. Tox21_201055

49. Bdbm50076273

50. Mfcd00189418

51. S9133

52. Akos000278435

53. Ccg-269487

54. Cs-4262

55. Butanedioic Acid, 2,3-bis(((2e)-3-(3,4-dihydroxphenyl)-1-oxo-2-propenyl)oxy)-, (2r,3r)-

56. ( -)-chicoric Acid, Analytical Standard

57. Ncgc00091914-01

58. Ncgc00091914-02

59. Ncgc00091914-04

60. Ncgc00258608-01

61. Ac-34315

62. Ac-36990

63. As-56447

64. Butanedioic Acid, 2,3-bis((3-(3,4-dihydroxphenyl)-1-oxo-2-propenyl)oxy)-, (r-(r*,r*-(e,e)))-

65. Cas-70831-56-0

66. C3450

67. 831c560

68. A914269

69. Q5119402

70. Tartaric Acid, Bis(3,4-dihydroxycinnamate)

71. 2,3-bis[3-(3,4-dihydroxyphenyl)prop-2-enoyloxy]butanedioic Acid

72. Chicoric Acid, United States Pharmacopeia (usp) Reference Standard

73. (2r,3r)-2,3-bis((3-(3,4-dihydroxyphenyl)acryloyl)oxy)succinic Acid

74. (2r,3r)-2,3-bis((e)-3-(3,4-dihydroxyphenyl)acryloyloxy)succinic Acid

75. (2r,3r)-2,3-bis-[(e)-3-(3,4-dihydroxy-phenyl)-acryloyloxy]-succinic Acid

76. (2r,3r)-2,3-bis[[3-(3,4-dihydroxyphenyl)-1-oxo-2-propenyl]oxy]butanedioic Acid

77. (2r,3r)-2,3-bis{[(2e)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy}succinic Acid

78. (2r,3r)-2,3-bis{[3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy}butanedioic Acid

79. [s-(r*,r*)]-2,3-bis[[3-(3,4-dihydroxyphenyl)-1-oxo-2-propenyl]oxy]butanedioic Acid

80. Butanedioic Acid, 2,3-bis(((2e)-3-(3,4-dihydroxyphenyl)-1-oxo-2-propen-1-yl)oxy)-, (2r,3r)-

81. Butanedioic Acid, 2,3-bis((3-(3,4-dihydroxyphenyl)-1-oxo-2-propenyl)oxy)-, (r-(r*,r*))-

82. Butanedioic Acid, 2,3-bis[[(2e)-3-(3,4-dihydroxyphenyl)-1-oxo-2-propenyl]oxy]-, (2r,3r)- (9ci)

83. Butanedioic Acid, 2,3-bis[[3-(3,4-dihydroxyphenyl)-1-oxo-2-propenyl]oxy]-, [r-[r*,r*-(e,e)]]-

84. Chicoric Acid (constituent Of Echinacea Angustifolia Root, Echinacea Pallida Root, Echinacea Purpurea Root And Echinacea Purpurea Aerial Parts) [dsc]

85. Ncgc00091914-04!(2r,3r)-2,3-bis[[(e)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy]butanedioic Acid

2.4 Create Date
2005-03-26
3 Chemical and Physical Properties
Molecular Weight 474.4 g/mol
Molecular Formula C22H18O12
XLogP32
Hydrogen Bond Donor Count6
Hydrogen Bond Acceptor Count12
Rotatable Bond Count11
Exact Mass474.07982601 g/mol
Monoisotopic Mass474.07982601 g/mol
Topological Polar Surface Area208 Ų
Heavy Atom Count34
Formal Charge0
Complexity740
Isotope Atom Count0
Defined Atom Stereocenter Count2
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

HIV Integrase Inhibitors

Inhibitors of HIV INTEGRASE, an enzyme required for integration of viral DNA into cellular DNA. (See all compounds classified as HIV Integrase Inhibitors.)


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Cichoric Acid Manufacturers

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

Cichoric Acid Suppliers

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

Cichoric Acid GMP

Cichoric Acid 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 Cichoric Acid 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 Cichoric Acid GMP manufacturer or Cichoric Acid GMP API supplier for your needs.

Cichoric Acid CoA

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

Cichoric Acid CoA mostly includes findings from lab analyses of a specific batch. For each Cichoric Acid 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.

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