N~2~-Palmitoyl-L-lysyl-N-[(2S)-4-amino-1-{[(1S,2R)-1-carboxy-2-hydroxypropyl]amino}-1-oxo-2-butanyl]-L-valinamide trifluoroacetate (1:2) | CAS No. 883558-32-5

N~2~-Palmitoyl-L-lysyl-N-[(2S)-4-amino-1-{[(1S,2R)-1-carboxy-2-hydroxypropyl]amino}-1-oxo-2-butanyl]-L-valinamide trifluoroacetate (1:2)

Basic Information

CAS Number

883558-32-5

Molecular Formula

C39H70F6N6O11

Molecular Weight

913 g/mol

AD

Basic Physical Properties

CCCCCCCCCCCCCCCC(=O)NC(CCCCN)C(=O)NC(C(C)C)C(=O)NC(CCN)C(=O)NC(C(C)O)C(=O)O.C(=O)(C(F)(F)F)O.C(=O)(C(F)(F)F)O

InChI

InChI=1S/C35H68N6O7.2C2HF3O2/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-21-29(43)38-27(20-18-19-23-36)32(44)40-30(25(2)3)34(46)39-28(22-24-37)33(45)41-31(26(4)42)35(47)48;2*3-2(4,5)1(6)7/h25-28,30-31,42H,5-24,36-37H2,1-4H3,(H,38,43)(H,39,46)(H,40,44)(H,41,45)(H,47,48);2*(H,6,7)/t26-,27+,28+,30+,31+;;/m1../s1

InChIKey

MCCUAUFXOWFEEM-LAUWSANRSA-N

LogP

4.27270000000001

Topological Polar Surface Area

300.57 Ų

Hydrogen Bond Donor/Acceptor

12 / 17

Complexity

1000

Synonyms & References

English

  • (2S,3R)-2-[[(2S)-4-amino-2-[[(2S)-2-[[(2S)-6-amino-2-(hexadecanoylamino)hexanoyl]amino]-3-methylbutanoyl]amino]butanoyl]amino]-3-hydroxybutanoic acid,2,2,2-trifluoroacetic acid
  • Palmitoyl Dipeptide-5
  • CL9S2UKN56
  • Palmitoyllysylvalyldiaminobutyroylthreonine trifluoroacetate
  • Palmitoyl dipeptide-5 diaminobutyroyl threonine trifluoroacetate
  • Palmitoyl dipeptide-5 diaminobutyroyl hydroxythreonine trifluoroacetate
  • L-Threonine, N2-(1-oxohexadecyl)-L-lysyl-L-valyl-(2S)-2,4-diaminobutanoyl-, bis(trifluoroacetate) (salt)
  • Q27275515

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