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Technical details about Prenylamine Lactate, learn more about the structure, uses, toxicity, action, side effects and more

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2D Structure
1. Also known as: 69-43-2, Prenylamine lactate [jan], 6j3j6sxi7v, Angormin, Coredamin, Corontin
Molecular Formula
C27H33NO3
Molecular Weight
419.6  g/mol
InChI Key
QPOFIDVRLWJICD-UHFFFAOYSA-N
FDA UNII
6J3J6SXI7V

1 2D Structure

2D Structure

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
3,3-diphenyl-N-(1-phenylpropan-2-yl)propan-1-amine;2-hydroxypropanoic acid
2.1.2 InChI
InChI=1S/C24H27N.C3H6O3/c1-20(19-21-11-5-2-6-12-21)25-18-17-24(22-13-7-3-8-14-22)23-15-9-4-10-16-23;1-2(4)3(5)6/h2-16,20,24-25H,17-19H2,1H3;2,4H,1H3,(H,5,6)
2.1.3 InChI Key
QPOFIDVRLWJICD-UHFFFAOYSA-N
2.1.4 Canonical SMILES
CC(CC1=CC=CC=C1)NCCC(C2=CC=CC=C2)C3=CC=CC=C3.CC(C(=O)O)O
2.2 Other Identifiers
2.2.1 UNII
6J3J6SXI7V
2.3 Synonyms
2.3.1 Depositor-Supplied Synonyms

1. 69-43-2

2. Prenylamine Lactate [jan]

3. 6j3j6sxi7v

4. Angormin

5. Coredamin

6. Corontin

7. Crepasin

8. Incoran

9. Irrorin

10. Plactamin

11. Reocorin

12. Seccidin

13. Sedolatan

14. Agozol

15. Roinin

16. Prenylamine Lactate (jan)

17. 3,3-diphenyl-n-(1-phenylpropan-2-yl)propan-1-amine;2-hydroxypropanoic Acid

18. Einecs 200-705-5

19. Unii-6j3j6sxi7v

20. Segontin (tn)

21. Prestwick_878

22. N-(3,3-diphenylpropyl)-alpha-methylphenethylamine Lactate

23. Dl-prenylamine Lactate

24. Mls002153874

25. Chembl1367944

26. Prenylamine Lactate [mi]

27. Schembl10614915

28. Hms1569p21

29. Hms2233j09

30. Hms3372i12

31. Hms3713p21

32. Phenethylamine, N-(3,3-diphenylpropyl)-alpha-methyl-, Lactate

33. Prenylamine Lactate [mart.]

34. Prenylamine Lactate [who-dd]

35. Ccg-220560

36. Smr001233228

37. D02167

38. Sr-01000838858

39. Sr-01000838858-2

40. Q27264978

41. Benzenepropanamine, N-(1-methyl-2-phenylethyl)-.gamma.-phenyl-, 2-hydroxypropanoate

42. Lactic Acid, Compd. With N-(3,3-diphenylpropyl)-.alpha.-methylphenethylamine (1:1)

43. 2-hydroxypropanoic Acid Compd. With N-(1-methyl-2-phenylethyl)-gamma-phenylbenzenepropanamine (1:1)

44. Propanoic Acid, 2-hydroxy-, Compd. With N-(1-methyl-2-phenylethyl)-.gamma.-phenylbenzenepropanamine (1:1)

2.4 Create Date
2005-06-24
3 Chemical and Physical Properties
Molecular Weight 419.6 g/mol
Molecular Formula C27H33NO3
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count9
Exact Mass419.24604391 g/mol
Monoisotopic Mass419.24604391 g/mol
Topological Polar Surface Area69.6 Ų
Heavy Atom Count31
Formal Charge0
Complexity375
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count2
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count2
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