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Chemistry

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Also known as: Levonordefrin hcl, 10390-18-8, Corbadrine hydrochloride, L-nordefrin hydrochloride, Nordefrin hcl, Dl-corbadrine hydrochloride

Molecular Formula

C₉H₁₄ClNO₃

Molecular Weight

219.66 g/mol

InChI Key

YRJLEOWRVNBAOI-WFZUHFMFSA-N

FDA UNII

NGO8K841ZV

A norepinephrine derivative used as a vasoconstrictor agent.

1 2D Structure

Levonordefrin Hydrochloride

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

4-[(1R,2S)-2-amino-1-hydroxypropyl]benzene-1,2-diol;hydrochloride

2.1.2 InChI

InChI=1S/C9H13NO3.ClH/c1-5(10)9(13)6-2-3-7(11)8(12)4-6;/h2-5,9,11-13H,10H2,1H3;1H/t5-,9-;/m0./s1

2.1.3 InChI Key

YRJLEOWRVNBAOI-WFZUHFMFSA-N

2.1.4 Canonical SMILES

CC(C(C1=CC(=C(C=C1)O)O)O)N.Cl

2.1.5 Isomeric SMILES

C[C@@H]([C@@H](C1=CC(=C(C=C1)O)O)O)N.Cl

2.2 Other Identifiers

2.2.1 UNII

NGO8K841ZV

2.3 Synonyms

2.3.1 MeSH Synonyms

1. 3,4 Dihydroxynorephedrine

2. 3,4-dihydroxynorephedrine

3. 4-(2-amino-1-hydroxypropyl)-1,2-benzenediol

4. 4-(2-amino-1-hydroxypropyl)-1,2-benzenediol Hydrochloride, (r*,r*)-(+,-)-isomer

5. 4-(2-amino-1-hydroxypropyl)-1,2-benzenediol Hydrochloride, (r*,s*)-(+-)-isomer

6. 4-(2-amino-1-hydroxypropyl)-1,2-benzenediol Tartrate, (r*,r*), (r*,r*)-isomer

7. 4-(2-amino-1-hydroxypropyl)-1,2-benzenediol Tartrate, (r*,s*), (r*,r*)-isomer

8. 4-(2-amino-1-hydroxypropyl)-1,2-benzenediol, (r*,r*)-isomer

9. 4-(2-amino-1-hydroxypropyl)-1,2-benzenediol, (r*,s*)-isomer

10. Alpha Methylnoradrenaline

11. Alpha Methylnorepinephrine

12. Alpha-methylnoradrenaline

13. Alpha-methylnorepinephrine

14. Cobefrine

15. Corbadrine

16. Hydrochloride, Nordefrin

17. Levonordefrin

18. Methylnorepinephrine

19. Neo Cobefrin

20. Neo-cobefrin

21. Neocobefrin

22. Nordefrin

23. Nordefrin Hydrochloride

24. Nordefrin Hydrochloride, (r*,r*)-(+,-)-isomer

25. Nordefrin Hydrochloride, (r*,s*)-(+,-)-isomer

26. Nordefrin Tartrate, (r*,r*), (r*,r*) Isomer

27. Nordefrin Tartrate, (r*,s*), (r*,r*) Isomer

28. Nordefrin, (r*,r*)-isomer

29. Nordefrin, (r*,s*)-isomer

30. Norephrine

2.3.2 Depositor-Supplied Synonyms

1. Levonordefrin Hcl

2. 10390-18-8

3. Corbadrine Hydrochloride

4. L-nordefrin Hydrochloride

5. Nordefrin Hcl

6. Dl-corbadrine Hydrochloride

7. Ngo8k841zv

8. U63s13uaor

9. 61-96-1

10. Nordefrin Hydrochloride

11. 1,2-benzenediol,4-[(1r,2s)-2-amino-1-hydroxypropyl]-, Hydrochloride (1:1)

12. Corbadrine Hcl

13. (r-(r*,s*))-4-(2-amino-1-hydroxypropyl)pyrocatechol Hydrochloride

14. [r-(r*,s*)]-4-(2-amino-1-hydroxypropyl)pyrocatechol Hydrochloride

15. Unii-u63s13uaor

16. (-)-nordefrin Hydrochloride

17. Cobefrin

18. Corbasil

19. 4-[(1r,2s)-2-amino-1-hydroxypropyl]benzene-1,2-diol;hydrochloride

20. Einecs 233-853-4

21. (-)-alpha-methylnoradrenaline Hydrochloride

22. Unii-ngo8k841zv

23. Schembl363800

24. Dtxsid00146134

25. Einecs 200-524-1

26. Nordefrin Hydrochloride [mi]

27. (+/-)-cobefrin Hydrochloride

28. Nordefrin Hydrochloride [who-dd]

29. Corbadrine Hydrochloride [who-dd]

30. Nordefrin Hydrochloride (r*,s*)-(+-)-

31. (+/-)-.alpha.-methylnoradrenaline Hydrochloride

32. (r*,s*)-(1)-4-(2-amino-1-hydroxypropyl)pyrocatechol Hydrochloride

33. (+/-)-ga-(1-aminoethyl)-3,4-dihydroxybenzyl Alcohol Hydrochloride

34. (-)-2-amino-1-(3,4-dihydroxyphenyl)propan-1-ol Hydrochloride

35. 1,2-benzenediol, 4-((1r,2s)-2-amino-1-hydroxypropyl)-, Hydrochloride (1:1)

36. 1,2-benzenediol, 4-((1r,2s)-2-amino-1-hydroxypropyl)-, Hydrochloride, Rel-

37. 1,2-benzenediol, 4-((1r,2s)-2-amino-1-hydroxypropyl)-, Hydrochloride (1:1), Rel-

38. Benzyl Alcohol, .alpha.-(1-aminoethyl)-3,4-dihydroxy-, Hydrochloride, Erythro-(+/-)-

2.4 Create Date

2007-12-05

3 Chemical and Physical Properties

Molecular Formula	C₉H₁₄ClNO₃
Molecular Weight	219.66 g/mol
Hydrogen Bond Donor Count	5
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	2
Exact Mass	219.0662210 g/mol
Monoisotopic Mass	219.0662210 g/mol
Topological Polar Surface Area	86.7 Å²
Heavy Atom Count	14
Formal Charge	0
Complexity	165
Isotope Atom Count	0
Defined Atom Stereocenter Count	2
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

Vasoconstrictor Agents

Drugs used to cause constriction of the blood vessels. (See all compounds classified as Vasoconstrictor Agents.)

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