Asparagine

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Systematic / IUPAC Name: 4-Iminohomoserine

ID: Reference326

Other Names: Asparamide;
α-Aminosuccinamic acid;
2-Aminosuccinamic acid;
(S)-2,4-Diamino-4-oxobutanoic acid;
Aspartic acid amide ; more

Formula: C4H8N2O3

Class: Endogenous Metabolites

Spectral Data

Asparagine 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 2
No. of Spectra 354
Tandem Spectra MS1, MS2, MS3
Ionization Methods ESI
Analyzers FT
Last Modification 12/16/2014 1:48:01 PM
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Identificators

InChI InChI=1S/C4H8N2O3/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H2,6,7)(H,8,9)/t2-/m0/s1
InChI Key DCXYFEDJOCDNAF-REOHCLBHSA-N
Canonical SMILES C(C(C(=O)O)N)C(=N)O
CAS 3130878
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Other Names Asparamide;
α-Aminosuccinamic acid;
2-Aminosuccinamic acid;
(S)-2,4-Diamino-4-oxobutanoic acid;
Aspartic acid amide;
L-2,4-Diamino-4-oxobutanoic acid;
Aspartic acid β-amide;
L-2-Aminosuccinamic acid;
L-Aspartic acid β-amide;
(2S)-2,4-Diamino-4-oxobutanoic acid;
2-Aminosuccinamic acid, L-;
(2S)-2-Amino-3-carbamoylpropanoic acid;
(S)-2-Amino-3-carbamoylpropanoic acid;
2,4-Diamino-4-oxobutanoic acid, (S)-;
(S)-2-Aminosuccinic acid 4-amide;
L-Asparagine;
Asparagine;
Agedoite;
Altheine;
Crystal VI;
L-Aspartamine;
Asn;
L-β-Asparagine;
L-Asparagin;
L-Asn

In Other Databases

ChemSpider 231
HMDb HMDB00168
ChEBI CHEBI:17196; CHEBI:58048
KEGG C00152
PubChem 6267; 6992089
ChEMBL CHEMBL58832
ChemIDPlus 000070473; 016079519
Wikipedia Asparagine