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Also known as: 6429-04-5, Tetrahydropapaverine hydrochloride, Tetrahydropapaverine hcl, Tetrahydroalkali hydrochloride, Dl-norlaudanosine hydrochloride, Norlaudanosine hydrochloride
Molecular Formula
C20H26ClNO4
Molecular Weight
379.9  g/mol
InChI Key
VMPLLPIDRGXFTQ-UHFFFAOYSA-N

CAS 6429-04-5
1 2D Structure

CAS 6429-04-5

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline;hydrochloride
2.1.2 InChI
InChI=1S/C20H25NO4.ClH/c1-22-17-6-5-13(10-18(17)23-2)9-16-15-12-20(25-4)19(24-3)11-14(15)7-8-21-16;/h5-6,10-12,16,21H,7-9H2,1-4H3;1H
2.1.3 InChI Key
VMPLLPIDRGXFTQ-UHFFFAOYSA-N
2.1.4 Canonical SMILES
COC1=C(C=C(C=C1)CC2C3=CC(=C(C=C3CCN2)OC)OC)OC.Cl
2.2 Synonyms
2.2.1 MeSH Synonyms

1. Tetrahydropapaverine

2. Tetrahydropapaverine Hydrochloride

2.2.2 Depositor-Supplied Synonyms

1. 6429-04-5

2. Tetrahydropapaverine Hydrochloride

3. Tetrahydropapaverine Hcl

4. Tetrahydroalkali Hydrochloride

5. Dl-norlaudanosine Hydrochloride

6. Norlaudanosine Hydrochloride

7. Schembl6382627

8. Tetrahydropapaverine Hydrochlorid

9. Tetrahydropapaverine (hydrochloride)

10. Mfcd00035267

11. 1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline;hydrochloride

12. 1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline Hydrochloride

13. 1-(3,4-dimethoxybenzyl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline Hcl

14. Pubchem14134

15. Mfcd03788189

16. Tetrahydropapaverinehydrochloride

17. Ctk6j7467

18. Norlaudanosine Hcl

19. St50409679

20. Molport-001-770-233

21. Bcp22904

22. Bcp22905

23. Hy-n0137

24. Ccg-49784

25. Nsc118072

26. (r)-tetrahydropapaverine Hydrochloride

27. Akos015900355

28. Ac-8778

29. Ds-2672

30. H29t045

31. Nsc-118072

32. 1-(3,4-dimethoxybenzyl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolinehydrochloride

33. Ak109367

34. Isoquinoline, 1-[(3,4-dimethoxyphenyl)methyl]-1,2,3,4-tetrahydro-6,7-dimethoxy-, Hydrochloride (1:1)

35. Sy037149

36. Sy258049

37. Db-016699

38. Db-050126

39. Cs-0007858

40. N0918

41. Papaverine,2,3,4-tetrahydro-, Hydrochloride

42. Sw219265-1

43. A806141

44. Q-101021

45. Sr-01000639215-1

46. (r)-1,2,3,4-tetrahydro-6,7-dimethoxy-1-veratrylisoquinoline

47. 1,2,3,4-tetrahydro-1-(3,4-dimethoxybenzyl)-6,7-dimethoxyisoquinoline Hydrochloride

48. 1-(4,5-dimethoxybenzyl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline-hydrochloride

49. 1-(4,5-dimethoxybenzyl)6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline-hydrochloride

2.3 Create Date
2007-08-14
3 Chemical and Physical Properties
Molecular Weight 379.9 g/mol
Molecular Formula C20H26ClNO4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count6
Exact Mass379.1550360 g/mol
Monoisotopic Mass379.1550360 g/mol
Topological Polar Surface Area49 Ų
Heavy Atom Count26
Formal Charge0
Complexity407
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count2

BUILDING BLOCK

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