Dimemorfanphosphate

Synopsis, Chemistry

APIs // Active Pharmaceutical Ingredients

1 API Suppliers, 1 JDMF

Product Search

API SUPPLIERS

API Suppliers

US DMFs Filed

CEP/COS Certifications

JDMFs Filed

EU WC

Listed Suppliers

API REF. PRICE (USD / KG)

API Market Place

INTERMEDIATES

DOSSIERS // FDF

USA (Orange Book)

Europe

Canada

Australia

South Africa

Uploaded Dossiers

GLOBAL SALES (USD Million)

U.S. Medicaid

Annual Reports

FDF Market Place

EXCIPIENTS

PATENTS & EXCLUSIVITIES

USFDA Orange Book Patents

USFDA Exclusivities

DIGITAL CONTENT

Blog #PharmaFlow

News

REF STANDARD

EDQM

USP

Other Listed Suppliers

SERVICES

Also known as: 36304-84-4, Astomin, Dimemorfan phosphate [jan], S203y5y1qp, Dimemorfan (phosphate), (1s,9s,10s)-4,17-dimethyl-17-azatetracyclo[7.5.3.01,10.02,7]heptadeca-2(7),3,5-triene;phosphoric acid

Molecular Formula

C₁₈H₂₈NO₄P

Molecular Weight

353.4 g/mol

InChI Key

ODJHDWLIOUGPPA-URVXVIKDSA-N

FDA UNII

S203Y5Y1QP

1 2D Structure

Dimemorfanphosphate

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

(1S,9S,10S)-4,17-dimethyl-17-azatetracyclo[7.5.3.01,10.02,7]heptadeca-2(7),3,5-triene;phosphoric acid

2.1.2 InChI

InChI=1S/C18H25N.H3O4P/c1-13-6-7-14-12-17-15-5-3-4-8-18(15,16(14)11-13)9-10-19(17)2;1-5(2,3)4/h6-7,11,15,17H,3-5,8-10,12H2,1-2H3;(H3,1,2,3,4)/t15-,17+,18+;/m1./s1

2.1.3 InChI Key

ODJHDWLIOUGPPA-URVXVIKDSA-N

2.1.4 Canonical SMILES

CC1=CC2=C(CC3C4C2(CCCC4)CCN3C)C=C1.OP(=O)(O)O

2.1.5 Isomeric SMILES

CC1=CC2=C(C[C@H]3[C@@H]4[C@]2(CCCC4)CCN3C)C=C1.OP(=O)(O)O

2.2 Other Identifiers

2.2.1 UNII

S203Y5Y1QP

2.3 Synonyms

2.3.1 MeSH Synonyms

1. Astomin

2. At 17

3. D-3-methyl-n-methylmorphinan

4. Dastosin

5. Dimemorfan

6. Dimemorfan Phosphate (1:1) Salt

7. Dimemorfan, (9alpha,13alpha,14alpha)-isomer

8. Dinemorphan

2.3.2 Depositor-Supplied Synonyms

1. 36304-84-4

2. Astomin

3. Dimemorfan Phosphate [jan]

4. S203y5y1qp

5. Dimemorfan (phosphate)

6. (1s,9s,10s)-4,17-dimethyl-17-azatetracyclo[7.5.3.01,10.02,7]heptadeca-2(7),3,5-triene;phosphoric Acid

7. 3,17-dimethylmorphinan

8. Gentus

9. At-17 Phosphate

10. Unii-s203y5y1qp

11. Einecs 252-958-6

12. D-3-methyl-n-methylmorphinan Phosphate

13. Ncgc00182065-02

14. Dsstox_cid_28649

15. Dsstox_rid_82919

16. Dsstox_gsid_48723

17. Schembl355270

18. Chembl3188434

19. Dtxsid4048723

20. Dimemorfan Phosphate [mi]

21. 3,17-dimethyl-9-alpha,13-alpha,14-alpha-morphinan Phosphate

22. (9-alpha,13-alpha,14-alpha)-3,17-dimethylmorphinan Phosphate

23. Hy-b2215

24. Tox21_113138

25. (9alpha,13alpha,14alpha)-3,17-dimethylmorphinan Dihydrogen Phosphate

26. Dimemorfan Phosphate [mart.]

27. S5280

28. Dimemorfan Phosphate [who-dd]

29. Akos015994725

30. Ccg-268065

31. Cs-7664

32. Ks-1259

33. 3,17-dimethylmorphinan Phosphate

34. Cas-36304-84-4

35. Morphinan, 3,17-dimethyl-, Phosphate (1:1)

36. Q27288466

37. Morphinan, 3,17-dimethyl-, (9-alpha,13-alpha,14-alpha)-, Phosphate (1:1)

2.4 Create Date

2005-08-09

3 Chemical and Physical Properties

Molecular Formula	C₁₈H₂₈NO₄P
Molecular Weight	353.4 g/mol
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	0
Exact Mass	353.17559537 g/mol
Monoisotopic Mass	353.17559537 g/mol
Topological Polar Surface Area	81 Å²
Heavy Atom Count	24
Formal Charge	0
Complexity	401
Isotope Atom Count	0
Defined Atom Stereocenter Count	3
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	2

4 Pharmacology and Biochemistry

4.1 MeSH Pharmacological Classification

Antitussive Agents

Agents that suppress cough. They act centrally on the medullary cough center. EXPECTORANTS, also used in the treatment of cough, act locally. (See all compounds classified as Antitussive Agents.)