L-Threonine

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Systematic / IUPAC Name: (2S,3R)-2-amino-3-hydroxybutanoic acid

ID: Reference1826

Other Names: Threonine;
L-(-)-Threonine;
2-Amino-3-hydroxybutyric acid;
(2S,3R)-2-Amino-3-hydroxybutanoic acid;
L-α-Amino-β-hydroxybutyric acid ; more

Formula: C4H9NO3

Class: Endogenous Metabolites

Spectral Data

L-Threonine mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Orbitrap Elite
No. of Spectral Trees 1
No. of Spectra 98
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 1/7/2015 9:31:35 AM
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Identificators

InChI InChI=1S/C4H9NO3/c1-2(6)3(5)4(7)8/h2-3,6H,5H2,1H3,(H,7,8)/t2-,3+/m1/s1
InChI Key AYFVYJQAPQTCCC-GBXIJSLDSA-N
Canonical SMILES CC(C(C(=O)O)N)O
CAS 72195
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Other Names Threonine;
L-(-)-Threonine;
2-Amino-3-hydroxybutyric acid;
(2S,3R)-2-Amino-3-hydroxybutanoic acid;
L-α-Amino-β-hydroxybutyric acid;
(2S,3R)-(-)-Threonine;
(2S,3R)-2-Amino-3-hydroxybutyric acid;
L-2-Amino-3-hydroxybutyric acid;
2-Amino-3-hydroxybutanoic acid, (R-(R*,S*))-;
Butanoic acid, 2-amino-3-hydroxy-, (R-(R*,S*))-;
[R-(R*,S*)]-2-Amino-3-hydroxybutanoic acid

In Other Databases

ChemSpider 6051
ChemIDPlus 000072195; 007013323
Wikipedia Threonine
ChEMBL CHEMBL291747
ChEBI CHEBI:16857; CHEBI:57926
PubChem 6288
HMDb HMDB00167
KEGG C00188; D00041