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Chemistry

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Also known as: 37106-97-1, Btpaba, Chymex, Bz-tyr-4-abz-oh, Bentiromido, Bentiromidum
Molecular Formula
C23H20N2O5
Molecular Weight
404.4  g/mol
InChI Key
SPPTWHFVYKCNNK-FQEVSTJZSA-N
FDA UNII
239IF5W61J

Bentiromide
Bentiromide is a dipeptide that is used in the bentiromide test, which is a screening test for evaluating pancreatic exocrine function and monitoring the adequacy of supplemental pancreatic therapy. It is typically administered orally. Cases of headache and gastrointestinal disturbances have been reported with the use of bentiromide. Bentiromide is currently not available in the U.S. or Canada.
1 2D Structure

Bentiromide

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
4-[[(2S)-2-benzamido-3-(4-hydroxyphenyl)propanoyl]amino]benzoic acid
2.1.2 InChI
InChI=1S/C23H20N2O5/c26-19-12-6-15(7-13-19)14-20(25-21(27)16-4-2-1-3-5-16)22(28)24-18-10-8-17(9-11-18)23(29)30/h1-13,20,26H,14H2,(H,24,28)(H,25,27)(H,29,30)/t20-/m0/s1
2.1.3 InChI Key
SPPTWHFVYKCNNK-FQEVSTJZSA-N
2.1.4 Canonical SMILES
C1=CC=C(C=C1)C(=O)NC(CC2=CC=C(C=C2)O)C(=O)NC3=CC=C(C=C3)C(=O)O
2.1.5 Isomeric SMILES
C1=CC=C(C=C1)C(=O)N[C@@H](CC2=CC=C(C=C2)O)C(=O)NC3=CC=C(C=C3)C(=O)O
2.2 Other Identifiers
2.2.1 UNII
239IF5W61J
2.3 Synonyms
2.3.1 MeSH Synonyms

1. Benzoyl-tyrosyl-paba

2. N-benzoyl-l-tyrosyl-p-aminobenzoic Acid

3. N-benzoyl-l-tyrosyl-paba

4. Paba-peptide

2.3.2 Depositor-Supplied Synonyms

1. 37106-97-1

2. Btpaba

3. Chymex

4. Bz-tyr-4-abz-oh

5. Bentiromido

6. Bentiromidum

7. Btpaba, Pft

8. Btpaba Pft

9. Bentiromidum [inn-latin]

10. Bentiromido [inn-spanish]

11. Btpabapft

12. Btpaba-pft

13. Benzoyltyrosyl-p-aminobenzoic Acid

14. E-2663

15. Pft

16. Chebi:31263

17. 239if5w61j

18. N-benzoyl-l-tyrosyl-p-aminobenzoic Acid

19. (s)-p-(alpha-benzamido-p-hydroxyhydrocinnamamido)benzoic Acid

20. 4-(n-benzoyl-l-tyrosyl)aminobenzoic Acid

21. 4-[[(2s)-2-benzamido-3-(4-hydroxyphenyl)propanoyl]amino]benzoic Acid

22. (s)-4-((2-(benzoylamino)-3-(4-hydroxyphenyl)-1-oxopropyl)amino)benzoic Acid

23. 4-[(2s)-3-(4-hydroxyphenyl)-2-(phenylformamido)propanamido]benzoic Acid

24. Benzoic Acid, 4-((2-(benzoylamino)-3-(4-hydroxyphenyl)-1-oxopropyl)amino)-, (s)-

25. P-((n-benzoyl-l-tyrosin)amido)benzoic Acid

26. Brn 2910938

27. Ro 11-7891

28. Unii-239if5w61j

29. 4-((2-(benzoylamino)-3-(4-hydroxyphenyl)-1-oxopropyl)amino)benzoic Acid

30. Bentiromide [usan:ban:inn:jan]

31. Bentiromide [usan:inn:ban:jan]

32. Einecs 253-349-8

33. Bt-paba

34. Bentiromide [mi]

35. Bentiromide [inn]

36. Bentiromide [jan]

37. Bentiromide [usan]

38. Bentiromide [vandf]

39. E 2663

40. Bentiromide [mart.]

41. Bentiromide [who-dd]

42. (s)-p-(.alpha.-benzamido-p-hydroxyhydrocinnamamido)benzoic Acid

43. Schembl151634

44. Chembl1200368

45. Dtxsid2048377

46. Bentiromide [orange Book]

47. Zinc608204

48. Hy-b1493

49. N-benzoyl-l-tyrosyl-p-aminobenzoate

50. Mfcd00055768

51. S4388

52. Ccg-268691

53. Db00522

54. 4-(n-benzoyl-l-tyrosyl)aminobenzoicacid

55. 4-(n-benzoyl-l-tyrosylamino)benzoic Acid

56. 4-[(n-benzoyl-l-tyrosyl)amino]benzoic Acid

57. Cs-0013190

58. Sw219774-1

59. Ab01566933_01

60. 106b971

61. Q793082

62. Sr-01000883958

63. Sr-01000883958-1

64. (s)-4-(2-benzamido-3-(4-hydroxyphenyl)propanamido)benzoic Acid

65. (4-[[(2s)-2-benzamido-3-(4-hydroxyphenyl)propanoyl]amino]benzoic Acid

2.4 Create Date
2006-07-28
3 Chemical and Physical Properties
Molecular Weight 404.4 g/mol
Molecular Formula C23H20N2O5
XLogP33.3
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count5
Rotatable Bond Count7
Exact Mass404.13722174 g/mol
Monoisotopic Mass404.13722174 g/mol
Topological Polar Surface Area116 Ų
Heavy Atom Count30
Formal Charge0
Complexity588
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1
4 Drug and Medication Information
4.1 Drug Indication

Indicated as a screening test for exocrine pancreatic insufficiency and to monitor the adequacy of supplemental pancreatic therapy.


5 Pharmacology and Biochemistry
5.1 Pharmacology

Bentiromide is a peptide used as a screening test for exocrine pancreatic insufficiency and to monitor the adequacy of supplemental pancreatic therapy. The amount of p-aminobenzoic acid and its metabolites excreted in the urine is the quantitative measure of the chymotrypsin-secreting activity of the pancreas.


5.2 MeSH Pharmacological Classification

Indicators and Reagents

Substances used for the detection, identification, analysis, etc. of chemical, biological, or pathologic processes or conditions. Indicators are substances that change in physical appearance, e.g., color, at or approaching the endpoint of a chemical titration, e.g., on the passage between acidity and alkalinity. Reagents are substances used for the detection or determination of another substance by chemical or microscopical means, especially analysis. Types of reagents are precipitants, solvents, oxidizers, reducers, fluxes, and colorimetric reagents. (From Grant and Hackh's Chemical Dictionary, 5th ed, p301, p499) (See all compounds classified as Indicators and Reagents.)


5.3 ATC Code

V - Various

V04 - Diagnostic agents

V04C - Other diagnostic agents

V04CK - Tests for pancreatic function

V04CK03 - Bentiromide


5.4 Metabolism/Metabolites

Primarily hepatic. Enzymatic activity capable of hydrolyzing bentiromide has also been found in normal small intestine.


5.5 Mechanism of Action

Bentiromide is a peptide that is broken down in the pancreas by chymotrypsin. By determining the output of unchanged bentiromide in the urine following oral administration, it is possible to determine the sufficiency of pancreatic activity.


ABOUT THIS PAGE

Bentiromide Manufacturers

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

Bentiromide Suppliers

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

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

Bentiromide USDMF

A Bentiromide DMF (Drug Master File) is a document detailing the whole manufacturing process of Bentiromide active pharmaceutical ingredient (API) in detail. Different forms of Bentiromide DMFs exist exist since differing nations have different regulations, such as Bentiromide USDMF, ASMF (EDMF), JDMF, CDMF, etc.

A Bentiromide DMF submitted to regulatory agencies in the US is known as a USDMF. Bentiromide USDMF includes data on Bentiromide's chemical properties, information on the facilities and procedures used, and details about packaging and storage. The Bentiromide USDMF is kept confidential to protect the manufacturer’s intellectual property.

click here to find a list of Bentiromide suppliers with USDMF on PharmaCompass.

Bentiromide GMP

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

Bentiromide CoA

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

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

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