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Chemistry

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Also known as: Dipalmitoylhydroxyproline, Dipamitoylhydroxyproline, Trans-o, n-dipalmitoylhydroxyproline, E6aha53n1h, Lipacide dphp, Sepilift dphp

Molecular Formula

C₃₇H₆₉NO₅

Molecular Weight

607.9 g/mol

InChI Key

QZLXCFQVOCEKSX-NOCHOARKSA-N

FDA UNII

E6AHA53N1H

1 2D Structure

Dipalmitoyl hydroxyproline

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

(2S,4R)-1-hexadecanoyl-4-hexadecanoyloxypyrrolidine-2-carboxylic acid

2.1.2 InChI

InChI=1S/C37H69NO5/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-35(39)38-32-33(31-34(38)37(41)42)43-36(40)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h33-34H,3-32H2,1-2H3,(H,41,42)/t33-,34+/m1/s1

2.1.3 InChI Key

QZLXCFQVOCEKSX-NOCHOARKSA-N

2.2 Other Identifiers

2.2.1 UNII

E6AHA53N1H

2.3 Synonyms

2.3.1 Depositor-Supplied Synonyms

1. Dipalmitoylhydroxyproline

2. Dipamitoylhydroxyproline

3. Trans-o, N-dipalmitoylhydroxyproline

4. E6aha53n1h

5. Lipacide Dphp

6. Sepilift Dphp

7. Ronacare Asc Iii

8. Einecs 255-490-0

9. Dtxsid60885734

10. Ec 255-490-0

11. O,n-dipalmitoylhydroxyproline

12. Trans-1-(1-oxohexadecyl)-4-((1-oxohexadecyl)oxy)-l-proline

13. Trans-1-(1-oxohexadecyl)-4-[(1-oxohexadecyl)oxy]-l-proline

14. L-proline, 1-(1-oxohexadecyl)-4-((1-oxohexadecyl)oxy)-, (4r)-

15. L-proline, 1-(1-oxohexadecyl)-4-((1-oxohexadecyl)oxy)-, Trans-

16. L-proline, 1-(1-oxohexadecyl)-4-[(1-oxohexadecyl)oxy]-, (4r)-

17. Refchem:588778

18. Dtxcid001025097

19. Dipalmitoyl Hydroxyproline [inci]

20. L-proline, 1-(1-oxohexadecyl)-4-(1-oxohexadecyl)oxy-, (4r)-

21. 41672-81-5

22. (2s,4r)-1-hexadecanoyl-4-hexadecanoyloxypyrrolidine-2-carboxylic Acid

23. Unii-e6aha53n1h

24. Schembl4403605

25. Qzlxcfqvoceksx-nochoarksa-n

26. Ns00008530

27. 672d815

28. Q27276932

2.4 Create Date

2005-08-08

3 Chemical and Physical Properties

Molecular Formula	C₃₇H₆₉NO₅
Molecular Weight	607.9 g/mol
XLogP3	14.1
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	31
Exact Mass	Da
Monoisotopic Mass	Da
Topological Polar Surface Area	83.9
Heavy Atom Count	43
Formal Charge	0
Complexity	696
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	1