Pentaglycine

Synopsis, Chemistry

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Also known as: 7093-67-6, Gly-gly-gly-gly-gly, H-gly-gly-gly-gly-gly-oh, N-(n-(n-(n-glycylglycyl)glycyl)glycyl)glycine, Glycylglycylglycylglycylglycine, 2-[[2-[[2-[[2-[(2-aminoacetyl)amino]acetyl]amino]acetyl]amino]acetyl]amino]acetic acid

Molecular Formula

C₁₀H₁₇N₅O₆

Molecular Weight

303.27 g/mol

InChI Key

MXHCPCSDRGLRER-UHFFFAOYSA-N

FDA UNII

ML48YN34T4

1 2D Structure

Pentaglycine

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

2-[[2-[[2-[[2-[(2-aminoacetyl)amino]acetyl]amino]acetyl]amino]acetyl]amino]acetic acid

2.1.2 InChI

InChI=1S/C10H17N5O6/c11-1-6(16)12-2-7(17)13-3-8(18)14-4-9(19)15-5-10(20)21/h1-5,11H2,(H,12,16)(H,13,17)(H,14,18)(H,15,19)(H,20,21)

2.1.3 InChI Key

MXHCPCSDRGLRER-UHFFFAOYSA-N

2.1.4 Canonical SMILES

C(C(=O)NCC(=O)NCC(=O)NCC(=O)NCC(=O)O)N

2.2 Other Identifiers

2.2.1 UNII

ML48YN34T4

2.3 Synonyms

2.3.1 Depositor-Supplied Synonyms

1. 7093-67-6

2. Gly-gly-gly-gly-gly

3. H-gly-gly-gly-gly-gly-oh

4. N-(n-(n-(n-glycylglycyl)glycyl)glycyl)glycine

5. Glycylglycylglycylglycylglycine

6. 2-[[2-[[2-[[2-[(2-aminoacetyl)amino]acetyl]amino]acetyl]amino]acetyl]amino]acetic Acid

7. Glycine, Glycylglycylglycylglycyl-

8. Chebi:114248

9. Ml48yn34t4

10. Nsc-96353

11. Glycine, N-(n-(n-(n-glycylglycyl)glycyl)glycyl)-

12. Glycine, N-[n-[n-(n-glycylglycyl)glycyl]glycyl]-

13. Tetraglycylglycine

14. Glycyl-glycyl-glycyl-glycyl-glycine

15. Nsc96353

16. Einecs 230-398-3

17. Gly-gly-gly-gly-gly-oh

18. Epitope Id:132954

19. Unii-ml48yn34t4

20. Chembl14390

21. Schembl391028

22. Dtxsid90221161

23. Zinc4545906

24. Mfcd00083696

25. Nsc 96353

26. Akos028110864

27. Hy-w141916

28. Bs-24396

29. Cs-0201707

30. Ft-0739294

31. N-{n-[n-(n-glycylglycyl)glycyl]glycyl}-glycine

32. Q27195645

33. 14-amino-4,7,10,13-tetraoxo-3,6,9,12-tetraazatetradecan-1-oic Acid

2.4 Create Date

2005-03-26

3 Chemical and Physical Properties

Molecular Formula	C₁₀H₁₇N₅O₆
Molecular Weight	303.27 g/mol
XLogP3	-4.9
Hydrogen Bond Donor Count	6
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	9
Exact Mass	303.11788328 g/mol
Monoisotopic Mass	303.11788328 g/mol
Topological Polar Surface Area	180 Å²
Heavy Atom Count	21
Formal Charge	0
Complexity	424
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	1