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Chemistry

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Also known as: 69049-74-7, Tilade, Alocril, Fpl 59002kp, Nedocromil sodium [usan], Rapitil
Molecular Formula
C19H15NNa2O7
Molecular Weight
415.3  g/mol
InChI Key
JQEKDNLKIVGXAU-UHFFFAOYSA-L
FDA UNII
ET8IF4KS1T

Nedocromil Sodium
A pyranoquinolone derivative that inhibits activation of inflammatory cells which are associated with ASTHMA, including EOSINOPHILS; NEUTROPHILS; MACROPHAGES; MAST CELLS; MONOCYTES; AND PLATELETS.
1 2D Structure

Nedocromil Sodium

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
disodium;9-ethyl-4,6-dioxo-10-propylpyrano[3,2-g]quinoline-2,8-dicarboxylate
2.1.2 InChI
InChI=1S/C19H17NO7.2Na/c1-3-5-9-16-10(13(21)7-12(18(23)24)20(16)4-2)6-11-14(22)8-15(19(25)26)27-17(9)11;;/h6-8H,3-5H2,1-2H3,(H,23,24)(H,25,26);;/q;2*+1/p-2
2.1.3 InChI Key
JQEKDNLKIVGXAU-UHFFFAOYSA-L
2.1.4 Canonical SMILES
CCCC1=C2C(=CC3=C1OC(=CC3=O)C(=O)[O-])C(=O)C=C(N2CC)C(=O)[O-].[Na+].[Na+]
2.2 Other Identifiers
2.2.1 UNII
ET8IF4KS1T
2.3 Synonyms
2.3.1 MeSH Synonyms

1. 9-ethyl-6,9-dihydro-4,6-dioxo-10-propyl-4h-pyrano(3,2-g)quinoline-2,8-dicarboxylic Acid

2. Alocril

3. Brionil

4. Calcium, Nedocromil

5. Cetimil

6. Fpl 59002

7. Fpl-59002

8. Fpl59002

9. Halamid

10. Irtan

11. Nedocromil

12. Nedocromil Calcium

13. Nedocromil, Calcium Salt (1:1)

14. Nedocromil, Disodium Salt

15. Nedocromil, Disodium Salt, Hydrate

16. Rapitil

17. Sodium, Nedocromil

18. Tilad

19. Tilade

20. Tilaire

21. Tilavist

2.3.2 Depositor-Supplied Synonyms

1. 69049-74-7

2. Tilade

3. Alocril

4. Fpl 59002kp

5. Nedocromil Sodium [usan]

6. Rapitil

7. Tilarin

8. Tayled

9. Fpl-59002kp

10. Nedocromil Disodium Salt

11. Et8if4ks1t

12. Chebi:7493

13. Sodium 9-ethyl-4,6-dioxo-10-propyl-6,9-dihydro-4h-pyrano[3,2-g]quinoline-2,8-dicarboxylate

14. Nedocromil Sodium (usan)

15. Disodium;9-ethyl-4,6-dioxo-10-propylpyrano[3,2-g]quinoline-2,8-dicarboxylate

16. 4h-pyrano(3,2-g)quinoline-2,8-dicarboxylic Acid, 9-ethyl-6,9-dihydro-4,6-dioxo-10-propyl-, Disodium Salt

17. Unii-et8if4ks1t

18. Abrevia

19. Tilavist

20. Alocril (tn)

21. Tilade (tn)

22. Chembl915

23. Disodium-9-ethyl-6,9-dihydro-4,6-dioxo-10-propyl-4h-pyrano(3,2-g)quinoline-2,8-dicarboxylate

24. Schembl24944

25. Nedocromil Sodium [jan]

26. Dtxsid00219115

27. Nedocromil Sodium [vandf]

28. Nedocromil Sodium [mart.]

29. Nedocromil Sodium [who-dd]

30. Nedocromil Disodium Salt [mi]

31. Akos015909770

32. Nedocromil Sodium [orange Book]

33. As-83242

34. Hy-16344

35. Cs-0006296

36. Ft-0603491

37. D00527

38. A915577

39. Q27107508

40. 4h-pyrano(3,2-g)quinoline-2,8-dicarboxylic Acid, 9-ethyl-6,9-dihydro-4,6-dioxo-10-propyl-, Sodium Salt (1:2)

41. Disodium 9-ethyl-4,6-dioxo-10-propyl-6,9-dihydro-4h-pyrano[3,2-g]quinoline-2,8-dicarboxylate

42. Disodium 9-ethyl-6,9-dihydro-4,6-dioxo-10-propyl-4h-pyrano-[3,2-g]-quinoline-2,8-dicarboxylate

2.4 Create Date
2005-06-24
3 Chemical and Physical Properties
Molecular Weight 415.3 g/mol
Molecular Formula C19H15NNa2O7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count8
Rotatable Bond Count3
Exact Mass415.06439038 g/mol
Monoisotopic Mass415.06439038 g/mol
Topological Polar Surface Area127 Ų
Heavy Atom Count29
Formal Charge0
Complexity742
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count3
4 Drug and Medication Information
4.1 Drug Information
1 of 4  
Drug NameAlocril
PubMed HealthNedocromil
Drug ClassesAntiasthma, Mast Cell Stabilizer, Ophthalmologic Agent
Drug LabelALOCRIL (nedocromil sodium ophthalmic solution) 2% is a clear, yellow, sterile solution for topical ophthalmic use.Nedocromil sodium is represented by the following structural formula:...
Active IngredientNedocromil sodium
Dosage FormSolution/drops
RouteOphthalmic
Strength2%
Market StatusPrescription
CompanyAllergan

2 of 4  
Drug NameNedocromil sodium
Drug LabelALOCRIL (nedocromil sodium ophthalmic solution) 2% is a clear, yellow, sterile solution for topical ophthalmic use.Nedocromil sodium is represented by the following structural formula:...
Active IngredientNedocromil sodium
Dosage FormSolution/drops
RouteOphthalmic
Strength2%
Market StatusPrescription
CompanyAkorn

3 of 4  
Drug NameAlocril
PubMed HealthNedocromil
Drug ClassesAntiasthma, Mast Cell Stabilizer, Ophthalmologic Agent
Drug LabelALOCRIL (nedocromil sodium ophthalmic solution) 2% is a clear, yellow, sterile solution for topical ophthalmic use.Nedocromil sodium is represented by the following structural formula:...
Active IngredientNedocromil sodium
Dosage FormSolution/drops
RouteOphthalmic
Strength2%
Market StatusPrescription
CompanyAllergan

4 of 4  
Drug NameNedocromil sodium
Drug LabelALOCRIL (nedocromil sodium ophthalmic solution) 2% is a clear, yellow, sterile solution for topical ophthalmic use.Nedocromil sodium is represented by the following structural formula:...
Active IngredientNedocromil sodium
Dosage FormSolution/drops
RouteOphthalmic
Strength2%
Market StatusPrescription
CompanyAkorn

5 Pharmacology and Biochemistry
5.1 MeSH Pharmacological Classification

Anti-Asthmatic Agents

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


Anti-Allergic Agents

Agents that are used to treat allergic reactions. Most of these drugs act by preventing the release of inflammatory mediators or inhibiting the actions of released mediators on their target cells. (From AMA Drug Evaluations Annual, 1994, p475) (See all compounds classified as Anti-Allergic Agents.)


Anti-Inflammatory Agents

Substances that reduce or suppress INFLAMMATION. (See all compounds classified as Anti-Inflammatory Agents.)


Mast Cell Stabilizers

Compounds that prevent the release of inflammatory mediators from MAST CELLS. (See all compounds classified as Mast Cell Stabilizers.)


5.2 FDA Pharmacological Classification
5.2.1 Pharmacological Classes
Mast Cell Stabilizer [EPC]; Decreased Histamine Release [PE]

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