N2-Acetyl-L-lysyl-D-alanyl-D-alanine
Basic information
- CAS
28845-97-8- Standard SMILES
CC(=O)N[C@@H](CCCCN)C(=O)N[C@H](C)C(=O)N[C@H](C)C(=O)O- InChIKey
GMSXMADYKTYBCP-KKZNHRDASA-N- Molecular formula
- C14H26N4O5
- Average molar mass
- 330.38 g/mol
- Monoisotopic mass
- 330.19031994
Overview
RN given refers to L-Lys-D-Ala-D-Ala-isomer
Names & identifiers
- Preferred name
- N2-Acetyl-L-lysyl-D-alanyl-D-alanine
- IUPAC
- (2R)-2-[[(2R)-2-[[(2S)-2-acetamido-6-aminohexanoyl]amino]propanoyl]amino]propanoic acid
- English name
- Ac-Lys-D-Ala-D-Ala-OH
- Molecular formula
- C14H26N4O5
- Molecular weight
- 330.38
Names & synonyms
28845-97-8Ac(2)-Lys-ala-alaN(2)-Acetyllysyl-alanyl-alanineRefChem:927393N2-Acetyl-L-lysyl-D-alanyl-D-alanineAc-Lys-D-Ala-D-Ala-OHMFCD00214242(2R)-2-[[(2R)-2-[[(2S)-2-acetamido-6-aminohexanoyl]amino]propanoyl]amino]propanoic acidC14H26N4O5N-ACETYL-L-LYS-D-ALA-D-ALAN(2)-Acetyl-L-lysyl-D-alanyl-D-alanineCHEMBL424767
Show more names
AC2-LYS-DALA-DALAAc-Lys-(D-Ala)2 -OHACETYL-LYS-D-ALA-D-ALAAcetyl-Lys-?-Ala-?-AlaN,N,DIACETYL-LYS-DALA-DALANa-Acetyl-Lys-D-Ala-D-Ala-OHAc-Lys-D-Ala-D-Ala-OH≥ 97% (HPLC)
SCHEMBL10609149DTXSID70951479Acetyl-L-lysyl-D-alanyl-D-alanineEX-A7454HY-P3729AS-86595D-Alanine, N2-acetyl-L-lysyl-D-alanyl-DA-50173
Database identifiers
- CAS
28845-97-8- PubChem CID
- 3082292
- DTXSID
Properties
Computed structural properties
- XLogP
- -3.5
- Topological polar surface area
- 151 Ų
- Hydrogen bond donors
- 5
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 10
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 441
Physicochemical properties
- Boiling point
- 731.1 · 731.1±60.0 °C(Predicted)
- Density
- 1.193 · 1.193±0.06 g/cm3(Predicted)
- storage temp.
- 20 °C · −20°C
- pka
- 3.43 · 3.43±0.10(Predicted)
- form
- powder
- Water Solubility
- 10 mg/mL, · water: 10mg/mL, clear, colorless
- UNSPSC Code
- 12352204 · 12352204
- NACRES
- 32 · NA.32
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
- WGK Germany
- 3 · 3
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- wgk
- 3
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Applications
UsesAc-Lys-D-Ala-D-Ala-OH is an oligopeptide. Ac-Lys-D-Ala-D-Ala-OH can be used for the research of various biochemical[1].
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…