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Chemistry

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Also known as: Zinc acexamate, 70020-71-2, Zinc;6-acetamidohexanoate, 811d513q1n, Hexanoic acid, 6-(acetylamino)-, zinc salt (2:1), Copinal
Molecular Formula
C16H28N2O6Zn
Molecular Weight
409.8  g/mol
InChI Key
GEVJDDLLVRRIOL-UHFFFAOYSA-L
FDA UNII
811D513Q1N

Epsilon-Acetamidocaproic Acid Zinc Salt
1 2D Structure

Epsilon-Acetamidocaproic Acid Zinc Salt

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
zinc;6-acetamidohexanoate
2.1.2 InChI
InChI=1S/2C8H15NO3.Zn/c2*1-7(10)9-6-4-2-3-5-8(11)12;/h2*2-6H2,1H3,(H,9,10)(H,11,12);/q;;+2/p-2
2.1.3 InChI Key
GEVJDDLLVRRIOL-UHFFFAOYSA-L
2.1.4 Canonical SMILES
CC(=O)NCCCCCC(=O)[O-].CC(=O)NCCCCCC(=O)[O-].[Zn+2]
2.2 Other Identifiers
2.2.1 UNII
811D513Q1N
2.3 Synonyms
2.3.1 MeSH Synonyms

1. 6-(acetylamino)hexanoic Acid

2. 6-acetamidohexanoic Acid

3. 6-acetylaminocaproic Acid

4. 6-acetylaminocaproic Acid, Calcium Salt

5. 6-acetylaminocaproic Acid, Monosodium Salt

6. Acexamic Acid

7. Celuton

8. Cy168e

9. Epsilon-acetylaminocaproic Acid

10. N-acetylamino-6-hexanoic Acid

11. Nas-501

12. Plastenan

13. Sodium Acexamate

14. Zinc Acexamate

2.3.2 Depositor-Supplied Synonyms

1. Zinc Acexamate

2. 70020-71-2

3. Zinc;6-acetamidohexanoate

4. 811d513q1n

5. Hexanoic Acid, 6-(acetylamino)-, Zinc Salt (2:1)

6. Copinal

7. Unii-811d513q1n

8. Copinal (tn)

9. Acexamate Zinc

10. Zinc 6-(acetylamino)hexanoate (2:1)

11. Schembl1643738

12. Acexamate Zinc [who-dd]

13. Dtxsid20220304

14. Zinc Acexamate [ep Monograph]

15. Zinc N-(acetylamino)-6-hexanoate

16. Db-082106

17. Ft-0687297

18. D07558

19. .epsilon.-acetamidocaproic Acid Zinc Salt

20. .epsilon.-acetamidocaproic Acid Zinc Salt [mi]

21. Q27269190

2.4 Create Date
2005-08-08
3 Chemical and Physical Properties
Molecular Weight 409.8 g/mol
Molecular Formula C16H28N2O6Zn
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count10
Exact Mass408.123878 g/mol
Monoisotopic Mass408.123878 g/mol
Topological Polar Surface Area139 Ų
Heavy Atom Count25
Formal Charge0
Complexity151
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count3
4 Pharmacology and Biochemistry
4.1 MeSH Pharmacological Classification

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.)


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