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Chemistry

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Also known as: 112665-43-7, Bronica, Abbott 73001, 7-phenyl-7-(2,4,5-trimethyl-3,6-dioxocyclohexa-1,4-dien-1-yl)heptanoic acid, Abt-001, Aa-2414
Molecular Formula
C22H26O4
Molecular Weight
354.4  g/mol
InChI Key
ZBVKEHDGYSLCCC-UHFFFAOYSA-N
FDA UNII
4U58JM421N

Seratrodast
Seratrodast (INN) is a thromboxane receptor antagonist used primarily in the treatment of asthma.
1 2D Structure

Seratrodast

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
7-phenyl-7-(2,4,5-trimethyl-3,6-dioxocyclohexa-1,4-dien-1-yl)heptanoic acid
2.1.2 InChI
InChI=1S/C22H26O4/c1-14-15(2)22(26)20(16(3)21(14)25)18(17-10-6-4-7-11-17)12-8-5-9-13-19(23)24/h4,6-7,10-11,18H,5,8-9,12-13H2,1-3H3,(H,23,24)
2.1.3 InChI Key
ZBVKEHDGYSLCCC-UHFFFAOYSA-N
2.1.4 Canonical SMILES
CC1=C(C(=O)C(=C(C1=O)C)C(CCCCCC(=O)O)C2=CC=CC=C2)C
2.2 Other Identifiers
2.2.1 UNII
4U58JM421N
2.3 Synonyms
2.3.1 MeSH Synonyms

1. 7-(3,5,6-trimethyl-1,4-benzoquinon-2-yl)-7-phenylheptanoic Acid

2. Aa 2414

3. Aa-2414

4. Abt-001

2.3.2 Depositor-Supplied Synonyms

1. 112665-43-7

2. Bronica

3. Abbott 73001

4. 7-phenyl-7-(2,4,5-trimethyl-3,6-dioxocyclohexa-1,4-dien-1-yl)heptanoic Acid

5. Abt-001

6. Aa-2414

7. Abbott-73001

8. Aa 2414

9. (+-)-7-(3,5,6-trimethyl-1,4-benzoquinon-2-yl)-7-phenylheptanoic Acid

10. A-73001

11. 103185-78-0

12. Nsc-759640

13. 4u58jm421n

14. Ncgc00181296-01

15. Dsstox_cid_1397

16. Dsstox_rid_76138

17. Dsstox_gsid_21397

18. Seratrodast [usan:inn]

19. Abt 001

20. (+/-)-2,4,5-trimethyl-3,6-dioxo-zeta-phenyl-1,4-cyclohexadiene-1-heptanoic Acid

21. Bronica (tn)

22. Ccris 8939

23. Cas-112665-43-7

24. A 73001

25. Unii-4u58jm421n

26. Seratrodast (jan/usan/inn)

27. 7-(3,5,6-trimethyl-1,4-benzoquinon-2-yl)-7-phenylheptanoic Acid

28. Seratrodast- Bio-x

29. Seratrodast [mi]

30. Seratrodast [inn]

31. Seratrodast [jan]

32. Seratrodast [usan]

33. (+-)-2,4,5-trimethyl-3,6-dioxo-zeta-phenyl-1,4-cyclohexadiene-1-heptanoic Acid

34. Benzeneheptanoic Acid, Zeta-(2,4,5-trimethyl-3,6-dioxo-1,4-cyclohexadien-1-yl)-, (+-)-

35. Seratrodast [mart.]

36. Schembl98402

37. Seratrodast [who-dd]

38. Mls006012011

39. Dtxsid4021397

40. Chebi:32126

41. Seratrodast, >=98% (hplc)

42. Hms3264k16

43. Hms3748i13

44. Pharmakon1600-01502336

45. Act02647

46. Bcp08860

47. Hy-b0774

48. Tox21_112774

49. Mfcd00875701

50. Nsc759640

51. S2072

52. Stl556121

53. (+/-)-7-(3,5,6-trimethyl-1,4-benzoquinon-2-yl)-7-phenylheptanoic Acid

54. Akos015911825

55. Seratrodast(aa-2414, Abt-001)

56. Tox21_112774_1

57. Ccg-207903

58. Db06739

59. Nsc 759640

60. 7-phenyl-7-(2,4,5-trimethyl-3,6-dioxo-1-cyclohexa-1,4-dienyl)heptanoic Acid

61. 7-phenyl-7-(2,4,5-trimethyl-3,6-dioxo-cyclohexa-1,4-dien-1-yl)heptanoic Acid

62. Ncgc00181296-02

63. As-12945

64. Bs164397

65. Smr002530529

66. Ft-0631064

67. D01123

68. Ab01563274_01

69. 665s437

70. A802627

71. L001973

72. Sr-01000944172

73. J-002813

74. Q7452735

75. Sr-01000944172-1

76. 6-(6-carboxy-1-phenylhexyl)-2,3,5-trimethylbenzoquinone

77. 7-(3,5,6-trimethyl-1,4-benzoquinone-2-yl)-7-phenylheptanoic Acid

78. 7-phenyl-7-(2,4,5-trimethyl-3,6-dioxo-1,4-cyclohexadienyl)heptanoic Acid

79. 7-phenyl-7-(2,4,5-trimethyl-3,6-dioxocyclohexa-1,4-dienyl)heptanoic Acid

80. (+/-)-2,4,5-trimethyl-3,6-dioxo-.zeta.-phenyl-1,4-cyclohexadiene-1-heptanoic Acid

81. 7-phenyl-7-[2,4,5-trimethyl-3,6-bis(oxidanylidene)cyclohexa-1,4-dien-1-yl]heptanoic Acid

82. Benzeneoctanoic Acid,h-(2,4,5-trimethyl-3,6-dioxo-1,4-cyclohexadien-1-yl)-

83. 103186-19-2

84. Benzeneheptanoic Acid, .zeta.-(2,4,5-trimethyl-3,6-dioxo-1,4-cyclohexadien-1-yl)-, (+/-)-

2.4 Create Date
2005-03-25
3 Chemical and Physical Properties
Molecular Weight 354.4 g/mol
Molecular Formula C22H26O4
XLogP34.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count8
Exact Mass354.18310931 g/mol
Monoisotopic Mass354.18310931 g/mol
Topological Polar Surface Area71.4 Ų
Heavy Atom Count26
Formal Charge0
Complexity633
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1
4 Pharmacology and Biochemistry
4.1 MeSH Pharmacological Classification

Anti-Asthmatic Agents

Drugs that are used to treat asthma. (See all compounds classified as Anti-Asthmatic Agents.)


Anti-Inflammatory Agents, Non-Steroidal

Anti-inflammatory agents that are non-steroidal in nature. In addition to anti-inflammatory actions, they have analgesic, antipyretic, and platelet-inhibitory actions. They act by blocking the synthesis of prostaglandins by inhibiting cyclooxygenase, which converts arachidonic acid to cyclic endoperoxides, precursors of prostaglandins. Inhibition of prostaglandin synthesis accounts for their analgesic, antipyretic, and platelet-inhibitory actions; other mechanisms may contribute to their anti-inflammatory effects. (See all compounds classified as Anti-Inflammatory Agents, Non-Steroidal.)


Prostaglandin Antagonists

Compounds that inhibit the action of prostaglandins. (See all compounds classified as Prostaglandin Antagonists.)


4.2 ATC Code

R - Respiratory system

R03 - Drugs for obstructive airway diseases

R03D - Other systemic drugs for obstructive airway diseases

R03DX - Other systemic drugs for obstructive airway diseases

R03DX06 - Seratrodast


4.3 Metabolism/Metabolites

Seratrodast has known human metabolites that include (2S,3S,4S,5R)-3,4,5-trihydroxy-6-[7-phenyl-7-(2,4,5-trimethyl-3,6-dioxocyclohexa-1,4-dien-1-yl)heptanoyl]oxyoxane-2-carboxylic acid.

S73 | METXBIODB | Metabolite Reaction Database from BioTransformer | DOI:10.5281/zenodo.4056560


ABOUT THIS PAGE

Looking for 112665-43-7 / Seratrodast API manufacturers, exporters & distributors?

Seratrodast manufacturers, exporters & distributors 1

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Send us enquiries for free, and we will assist you in establishing a direct connection with your preferred Seratrodast manufacturer or Seratrodast supplier.

PharmaCompass also assists you with knowing the Seratrodast API Price utilized in the formulation of products. Seratrodast API Price is not always fixed or binding as the Seratrodast Price is obtained through a variety of data sources. The Seratrodast Price can also vary due to multiple factors, including market conditions, regulatory modifications, or negotiated pricing deals.

API | Excipient name

Seratrodast

Synonyms

112665-43-7, Bronica, Abbott 73001, 7-phenyl-7-(2,4,5-trimethyl-3,6-dioxocyclohexa-1,4-dien-1-yl)heptanoic acid, Abt-001, Aa-2414

Cas Number

112665-43-7

Unique Ingredient Identifier (UNII)

4U58JM421N

About Seratrodast

Seratrodast (INN) is a thromboxane receptor antagonist used primarily in the treatment of asthma.

Seratrodast Manufacturers

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

click here to find a list of Seratrodast manufacturers with USDMF, JDMF, KDMF, CEP, GMP, COA and API Price related information on PhamaCompass.

Seratrodast Suppliers

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

click here to find a list of Seratrodast suppliers with USDMF, JDMF, KDMF, CEP, GMP, COA and API Price related information on PharmaCompass.

Seratrodast GMP

Seratrodast 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 Seratrodast 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 Seratrodast GMP manufacturer or Seratrodast GMP API supplier for your needs.

Seratrodast CoA

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

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

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