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Acetyl-L-threonine

CAT: 0572-TRC-A192013-100MGSize: 100 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-A192013-100MGSize:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
17093-74-2
Hazard Statement
Harmful if swallowed.
Purity
>95% (HPLC)
Smiles
C[C@H]([C@@H](C(=O)O)NC(=O)C)O
Molecular Formula
C6H11NO4
Molecular Weight
161.16
Shipping Conditions
Room Temperature
Storage Conditions
+4°C

Chemical Information

N-acetyl-L-threonine

N-acetyl-L-threonine is a N-acetyl-L-amino acid that is the N-acetyl derivative of L-threonine. It is a N-acetyl-L-amino acid and a L-threonine derivative. It is a conjugate acid of a N-acetyl-L-threoninate.

CAS Number17093-74-2
PubChem CID152204
IUPAC Name(2S,3R)-2-acetamido-3-hydroxybutanoic acid
Molecular FormulaC6H11NO4
Molecular Weight161.16
XLogP-0.9
Topological Polar Surface Area86.6
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Heavy Atom Count11
Formal Charge0
Complexity168
SMILES
C[C@H]([C@@H](C(=O)O)NC(=O)C)O
InChI
InChI=1S/C6H11NO4/c1-3(8)5(6(10)11)7-4(2)9/h3,5,8H,1-2H3,(H,7,9)(H,10,11)/t3-,5+/m1/s1
InChIKey
PEDXUVCGOLSNLQ-WUJLRWPWSA-N
Chemical Structure
2D Structure
2D structure of N-acetyl-L-threonine
CAS: 17093-74-2
CID: 152204
Formula: C6H11NO4
MW: 161.16
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight161.16
XLogP3-0.9
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Exact Mass161.06880783
Monoisotopic Mass161.06880783
Topological Polar Surface Area86.6 Ų
Heavy Atom Count11
Formal Charge0
Complexity168
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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