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N-Acetyl-L-alanine

CAT: 0957-S3094-100mgSize: 100 mgDry Ice: NoHazardous: No
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CAT#:0957-S3094-100mgSize:100 mg
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CAS Number
97-69-8
Synonyms
NAAL, Ac-Ala-OH
Target
Others
Applications
Others
Smiles
CC (NC (C) =O) C (O) =O
Molecular Formula
C5H9NO3
Additionnal Information
N-Acetyl-L-alanine (NAAL, Ac-Ala-OH) is an active endogenous metabolite.
Storage Conditions
3 years -20°C powder

Chemical Information

N-Acetyl-L-alanine

N-acetyl-L-alanine is an N-acetyl-L-amino acid that is L-alanine in which one of the hydrogens attached to the nitrogen is replaced by an acetyl group. It has a role as a Saccharomyces cerevisiae metabolite and a human metabolite. It is a N-acetyl-L-amino acid and a L-alanine derivative. It is a conjugate acid of a N-acetyl-L-alaninate.

CAS Number97-69-8
PubChem CID88064
IUPAC Name(2S)-2-acetamidopropanoic acid
Molecular FormulaC5H9NO3
Molecular Weight131.13
XLogP-0.9
Topological Polar Surface Area66.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Heavy Atom Count9
Formal Charge0
Complexity132
SMILES
C[C@@H](C(=O)O)NC(=O)C
InChI
InChI=1S/C5H9NO3/c1-3(5(8)9)6-4(2)7/h3H,1-2H3,(H,6,7)(H,8,9)/t3-/m0/s1
InChIKey
KTHDTJVBEPMMGL-VKHMYHEASA-N
Chemical Structure
2D Structure
2D structure of N-Acetyl-L-alanine
CAS: 97-69-8
CID: 88064
Formula: C5H9NO3
MW: 131.13
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight131.13
XLogP3-0.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass131.058243149
Monoisotopic Mass131.058243149
Topological Polar Surface Area66.4 Ų
Heavy Atom Count9
Formal Charge0
Complexity132
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