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Acetyl-L-lysine

CAT: 0931-T4856-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0931-T4856-01Size:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1946-82-3
Target
Endogenous Metabolite
Related Pathways
Metabolism
Purity
0.9983
Bioactivity
Acetyl-L-lysine (Nα-Acetyl-L-lysine) is a N-acetylated amino acid. It is a normal constituent of human urine with concentrations in normal samples too small to allow its routine detection; however, it has been found at increased levels in the urine of a patient with aminoacylase I deficiency.
Smiles
[C@@H](CCCCN)(NC(C)=O)C(O)=O
Molecular Formula
C8H16N2O3
Molecular Weight
188.22
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

N-Acetyl-L-Lysine

N(2)-acetyl-L-lysine is an acetyl-L-lysine where the acetyl group is located at the N2-posiiton. It has a role as a human metabolite. It is a tautomer of a N(2)-acetyl-L-lysine zwitterion.

CAS Number1946-82-3
PubChem CID92907
IUPAC Name(2S)-2-acetamido-6-aminohexanoic acid
Molecular FormulaC8H16N2O3
Molecular Weight188.22
XLogP-4.4
Topological Polar Surface Area92.4
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count6
Heavy Atom Count13
Formal Charge0
Complexity182
SMILES
CC(=O)N[C@@H](CCCCN)C(=O)O
InChI
InChI=1S/C8H16N2O3/c1-6(11)10-7(8(12)13)4-2-3-5-9/h7H,2-5,9H2,1H3,(H,10,11)(H,12,13)/t7-/m0/s1
InChIKey
VEYYWZRYIYDQJM-ZETCQYMHSA-N
Chemical Structure
2D Structure
2D structure of N-Acetyl-L-Lysine
CAS: 1946-82-3
CID: 92907
Formula: C8H16N2O3
MW: 188.22
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight188.22
XLogP3-4.4
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count6
Exact Mass188.11609238
Monoisotopic Mass188.11609238
Topological Polar Surface Area92.4 Ų
Heavy Atom Count13
Formal Charge0
Complexity182
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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