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CAS 52446-25-0
Also known as: Noroxycodone hydrochloride, 52446-25-0, T3m7lq6q2y, 7,8-dihydro-14-hydroxynorcodeinone hydrochloride, (4r,4as,7ar,12bs)-4a-hydroxy-9-methoxy-1,2,3,4,5,6,7a,13-octahydro-4,12-methanobenzofuro[3,2-e]isoquinolin-7-one;hydrochloride, Thecodinum
Molecular Formula
C17H20ClNO4
Molecular Weight
337.8  g/mol
InChI Key
IGNAMRAQFUFUMH-KCTCKCTRSA-N
FDA UNII
T3M7LQ6Q2Y

A semisynthetic derivative of CODEINE.
1 2D Structure

CAS 52446-25-0

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
(4R,4aS,7aR,12bS)-4a-hydroxy-9-methoxy-1,2,3,4,5,6,7a,13-octahydro-4,12-methanobenzofuro[3,2-e]isoquinolin-7-one;hydrochloride
2.1.2 InChI
InChI=1S/C17H19NO4.ClH/c1-21-11-3-2-9-8-12-17(20)5-4-10(19)15-16(17,6-7-18-12)13(9)14(11)22-15;/h2-3,12,15,18,20H,4-8H2,1H3;1H/t12-,15+,16+,17-;/m1./s1
2.1.3 InChI Key
IGNAMRAQFUFUMH-KCTCKCTRSA-N
2.1.4 Canonical SMILES
COC1=C2C3=C(CC4C5(C3(CCN4)C(O2)C(=O)CC5)O)C=C1.Cl
2.1.5 Isomeric SMILES
COC1=C2C3=C(C[C@@H]4[C@]5([C@]3(CCN4)[C@@H](O2)C(=O)CC5)O)C=C1.Cl
2.2 Other Identifiers
2.2.1 UNII
T3M7LQ6Q2Y
2.3 Synonyms
2.3.1 MeSH Synonyms

1. Dihydrohydroxycodeinone

2. Dihydrone

3. Dinarkon

4. Eucodal

5. Oxiconum

6. Oxycodeinon

7. Oxycodone

8. Oxycodone Hydrochloride

9. Oxycone

10. Oxycontin

11. Pancodine

12. Theocodin

2.3.2 Depositor-Supplied Synonyms

1. Noroxycodone Hydrochloride

2. 52446-25-0

3. T3m7lq6q2y

4. 7,8-dihydro-14-hydroxynorcodeinone Hydrochloride

5. (4r,4as,7ar,12bs)-4a-hydroxy-9-methoxy-1,2,3,4,5,6,7a,13-octahydro-4,12-methanobenzofuro[3,2-e]isoquinolin-7-one;hydrochloride

6. Thecodinum

7. Dinarkon

8. Eucodal

9. Eukodal

10. Eutagen

11. Oxygesic

12. Oxykodal

13. Oxynorm

14. Rexista

15. Stupenone

16. Tecodin

17. Tecodine

18. Tekodin

19. Thecodin

20. Thecodine

21. Thekodin

22. Oxikon

23. Oxycon

24. Oxykon

25. Oxycodone Xr

26. (4r,4as,7ar,12bs)-4a-hydroxy-9-methoxy-1,2,3,4,5,6,7a,13-octahydro-4,12-methanobenzofuro[3,2-e]isoquinoline-7-one;hydrochloride

27. Percodan Hydrochloride

28. Unii-c1enj2te6c

29. Unii-t3m7lq6q2y

30. Einecs 204-717-1

31. Oxycodone Hydrochloride [usan:usp:jan]

32. Noroxycodone Hydrochloride 1.0 Mg/ml In Methanol (as Free Base)

33. 4,5-epoxy-14-hydroxy-3-methoxy-17-methyl-morphinan-6-one, Hydrochloride, (5-alpha)-

34. Morphinan-6-one, 4,5-alpha-epoxy-14-hydroxy-3-methoxy-17-methyl-, Hydrochloride

35. Morphinan-6-one, 4,5-epoxy-14-hydroxy-3-methoxy-, Hydrochloride (1:1), (5alpha)-

36. Morphinan-6-one, 4,5-epoxy-14-hydroxy-3-methoxy-, Hydrochloride, (5.alpha.)-

37. Morphinan-6-one, 4,5-epoxy-14-hydroxy-3-methoxy-, Hydrochloride, (5alpha)-

38. Morphinan-6-one, 4,5-epoxy-14-hydroxy-3-methoxy-17-methyl-, Hydrochloride, (5alpha)-

39. 4,5alpha-epoxy-14-hydroxy-3-methoxymorphinan-6-one Hydrochloride (noroxycodone Hydrochloride)

40. Morphinan-6-one, 4,5-epoxy-14-hydroxy-3-methoxy-, Hydrochloride (1:1), (5.alpha.)-

41. Noroxycodone Hydrochloride Solution, 1.0 Mg/ml In Methanol (as Free Base), Ampule Of 1 Ml, Certified Reference Material

2.4 Create Date
2015-11-02
3 Chemical and Physical Properties
Molecular Weight 337.8 g/mol
Molecular Formula C17H20ClNO4
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count1
Exact Mass337.1080858 g/mol
Monoisotopic Mass337.1080858 g/mol
Topological Polar Surface Area67.8 Ų
Heavy Atom Count23
Formal Charge0
Complexity525
Isotope Atom Count0
Defined Atom Stereocenter Count4
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count2
4 Pharmacology and Biochemistry
4.1 MeSH Pharmacological Classification

Analgesics, Opioid

Compounds with activity like OPIATE ALKALOIDS, acting at OPIOID RECEPTORS. Properties include induction of ANALGESIA or NARCOSIS. (See all compounds classified as Analgesics, Opioid.)


Narcotics

Agents that induce NARCOSIS. Narcotics include agents that cause somnolence or induced sleep (STUPOR); natural or synthetic derivatives of OPIUM or MORPHINE or any substance that has such effects. They are potent inducers of ANALGESIA and OPIOID-RELATED DISORDERS. (See all compounds classified as Narcotics.)


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