Please Wait
Applying Filters...
Menu
$ API Ref.Price (USD/KG) : 90Xls
2D Structure
Also known as: 3230-94-2, L-ornithine-l-aspartate, L-ornithine l-aspartate salt, Ornithine aspartate, (s)-2,5-diaminopentanoic acid compound with (s)-2-aminosuccinic acid (1:1), Ornithine aseparate
Molecular Formula
C9H19N3O6
Molecular Weight
265.26  g/mol
InChI Key
IXUZXIMQZIMPSQ-ZBRNBAAYSA-N
FDA UNII
JA08T3B97O

1 2D Structure

2D Structure

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
(2S)-2-aminobutanedioic acid;(2S)-2,5-diaminopentanoic acid
2.1.2 InChI
InChI=1S/C5H12N2O2.C4H7NO4/c6-3-1-2-4(7)5(8)9;5-2(4(8)9)1-3(6)7/h4H,1-3,6-7H2,(H,8,9);2H,1,5H2,(H,6,7)(H,8,9)/t4-;2-/m00/s1
2.1.3 InChI Key
IXUZXIMQZIMPSQ-ZBRNBAAYSA-N
2.1.4 Canonical SMILES
C(CC(C(=O)O)N)CN.C(C(C(=O)O)N)C(=O)O
2.1.5 Isomeric SMILES
C(C[C@@H](C(=O)O)N)CN.C([C@@H](C(=O)O)N)C(=O)O
2.2 Other Identifiers
2.2.1 UNII
JA08T3B97O
2.3 Synonyms
2.3.1 MeSH Synonyms

1. Gepa-merz

2. L-ornithine-l-aspartate

3. Orn-asp

4. Ornithine Aspartate

5. Ornithylaspartate

2.3.2 Depositor-Supplied Synonyms

1. 3230-94-2

2. L-ornithine-l-aspartate

3. L-ornithine L-aspartate Salt

4. Ornithine Aspartate

5. (s)-2,5-diaminopentanoic Acid Compound With (s)-2-aminosuccinic Acid (1:1)

6. Ornithine Aseparate

7. L-aspartic Acid, Compd. With L-ornithine (1:1)

8. (2s)-2-aminobutanedioic Acid;(2s)-2,5-diaminopentanoic Acid

9. Ornithine Aspartate (l-ornithine L-aspartate)

10. Mfcd00058084

11. Hepa-merz (tn)

12. Lola

13. Ruigan

14. Schembl361185

15. Dtxsid30883964

16. Bcp13530

17. Hy-a0282

18. Ornithine Aspartate [who-dd]

19. L-ornithine L-aspartate Salt, Powder

20. Akos015998595

21. L-ornithine-l-aspartate (salt)

22. Ornithine L-form Aspartate [mi]

23. As-12577

24. L-ornithine, L-aspartate (1:1)

25. Aspartic Acid Compd. With Ornithine

26. Cs-0019764

27. O0440

28. Ornithine, L-, L-aspartate (1:1)

29. D08303

30. D70545

31. A821231

32. Q-102756

33. Q27281401

34. (s)-2,5-diaminopentanoic Acid (s)-2-aminosuccinic Acid Salt

35. (s)-2,5-diaminopentanoicacidcompoundwith(s)-2-aminosuccinicacid(1:1)

2.4 Create Date
2006-10-25
3 Chemical and Physical Properties
Molecular Weight 265.26 g/mol
Molecular Formula C9H19N3O6
Hydrogen Bond Donor Count6
Hydrogen Bond Acceptor Count9
Rotatable Bond Count7
Exact Mass265.12738533 g/mol
Monoisotopic Mass265.12738533 g/mol
Topological Polar Surface Area190 Ų
Heavy Atom Count18
Formal Charge0
Complexity228
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count2