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Chemistry

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Also known as: 214047-00-4, Matrixyl, (2s,5s,8s,11s,14s)-5,14-bis(4-aminobutyl)-8,11-bis((r)-1-hydroxyethyl)-2-(hydroxymethyl)-4,7,10,13,16-pentaoxo-3,6,9,12,15-pentaazahentriacontan-1-oic acid, N2-(1-oxohexadecyl)-l-lysyl-l-threonyl-l-threonyl-l-lysyl-l-serine, Palmitoyl pentapeptide-3, Palmitoyl pentapeptide 4
Molecular Formula
C39H75N7O10
Molecular Weight
802.1  g/mol
InChI Key
WSGCRSMLXFHGRM-DEVHWETNSA-N
FDA UNII
KK181SM5JG

Matrixyl
1 2D Structure

Matrixyl

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
(2S)-2-[[(2S)-6-amino-2-[[(2S,3R)-2-[[(2S,3R)-2-[[(2S)-6-amino-2-(hexadecanoylamino)hexanoyl]amino]-3-hydroxybutanoyl]amino]-3-hydroxybutanoyl]amino]hexanoyl]amino]-3-hydroxypropanoic acid
2.1.2 InChI
InChI=1S/C39H75N7O10/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-23-32(50)42-29(21-17-19-24-40)36(52)45-34(28(3)49)38(54)46-33(27(2)48)37(53)43-30(22-18-20-25-41)35(51)44-31(26-47)39(55)56/h27-31,33-34,47-49H,4-26,40-41H2,1-3H3,(H,42,50)(H,43,53)(H,44,51)(H,45,52)(H,46,54)(H,55,56)/t27-,28-,29+,30+,31+,33+,34+/m1/s1
2.1.3 InChI Key
WSGCRSMLXFHGRM-DEVHWETNSA-N
2.2 Other Identifiers
2.2.1 UNII
KK181SM5JG
2.3 Synonyms
2.3.1 MeSH Synonyms

1. Pal-kttks

2. Palmitoyl-lysyl-threonyl-threonyl-lysyl-serine

2.3.2 Depositor-Supplied Synonyms

1. 214047-00-4

2. Matrixyl

3. (2s,5s,8s,11s,14s)-5,14-bis(4-aminobutyl)-8,11-bis((r)-1-hydroxyethyl)-2-(hydroxymethyl)-4,7,10,13,16-pentaoxo-3,6,9,12,15-pentaazahentriacontan-1-oic Acid

4. N2-(1-oxohexadecyl)-l-lysyl-l-threonyl-l-threonyl-l-lysyl-l-serine

5. Palmitoyl Pentapeptide-3

6. Palmitoyl Pentapeptide 4

7. Palmitoyl Pentapeptide

8. (2s)-2-[[(2s)-6-amino-2-[[(2s,3r)-2-[[(2s,3r)-2-[[(2s)-6-amino-2-(hexadecanoylamino)hexanoyl]amino]-3-hydroxybutanoyl]amino]-3-hydroxybutanoyl]amino]hexanoyl]amino]-3-hydroxypropanoic Acid

9. Pal-kttks

10. Oristar Popp

11. Mfcd09842091

12. Lipopentapeptide 3

13. C39h75n7o10

14. Palmitoyl Pentapeptide?

15. Wsgcrsmlxfhgrm-devhwetnsa-n

16. Pal-lys-thr-thr-lys-ser

17. Kk181sm5jg

18. Schembl352420

19. Chembl451881

20. Hy-p0045

21. Akos027326911

22. As-72359

23. Cs-0005656

24. C74034

25. A902886

26. (2s)-2-[(2s)-6-amino-2-[(2s,3r)-2-[(2s,3r)-2-[(2s)-6-amino-2-hexadecanamidohexanamido]-3-hydroxybutanamido]-3-hydroxybutanamido]hexanamido]-3-hydroxypropanoic Acid

27. (2s,5s,8s,11s,14s)-5,14-bis(4-aminobutyl)-8,11-bis((r)-1-hydroxyethyl)-2-(hydroxymethyl)-4,7,10,13,16-pentaoxo-3,6,9,12,15-pentaazahentriacontan-1-oic Acid (palmitoyl-lys-thr-thr-lys-ser-oh)

2.4 Create Date
2006-10-25
3 Chemical and Physical Properties
Molecular Weight 802.1 g/mol
Molecular Formula C39H75N7O10
XLogP30.8
Hydrogen Bond Donor Count11
Hydrogen Bond Acceptor Count12
Rotatable Bond Count35
Exact Mass g/mol
Monoisotopic Mass g/mol
Topological Polar Surface Area296
Heavy Atom Count56
Formal Charge0
Complexity1130
Isotope Atom Count0
Defined Atom Stereocenter Count7
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1

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