| Number |
qtl-m1090 |
| Declustering Potential(DP) |
|
| Collision Energy(CE) |
|
| Observed mass(Da) |
|
| Exact mass(Da) |
|
| Accurate mass error(ppm) |
|
| Molecular formula |
|
| Ionization model |
|
| Ret. Time(min) |
|
| Precursor ions(Q1) |
133.1 |
| Product ions(Q3) |
74 |
| Main fragments |
|
| Compound |
L-Asparagine |
| Identification |
standard |
| class |
Amino acid |
| Organism |
|
| Reference |
|
| CV(%) |
|
| H2 |
|
| ChEBI_ID |
CHEBI:58048 |
| Agricola Citation Links |
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| ArrayExpress Database Links |
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| BRAND Names |
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| Beilstein Registry Numbers |
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| BioModels Database Links |
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| CAS Registry Numbers |
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| COMe Database Links |
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| ChEBI ID |
|
| ChEBI Name |
L-asparagine zwitterion;; |
| Charge |
0;; |
| Chinese Abstracts Citation Links |
|
| CiteXplore Citation Links |
|
| Definition |
Zwitterionic form of L-asparagine arising from transfer of a proton from the carboxy to the amino group; major species at pH 7.3.;; |
| DrugBank Database Links |
|
| Formulae |
C4H8N2O3;; |
| Gmelin Registry Numbers |
|
| INN |
|
| IUPAC Names |
(2S)-4-amino-2-azaniumyl-4-oxobutanoate;; |
| 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;; |
| InChIKey |
DCXYFEDJOCDNAF-REOHCLBHSA-N;; |
| IntAct Database Links |
|
| IntEnz Database Links |
EC 6.3.5.4;;EC 6.3.1.4;;EC 6.3.1.1;;EC 6.1.1.22;;EC 4.2.1.65;;EC 3.5.5.4;;EC 3.5.1.38;;EC 3.5.1.1;;EC 3.2.2.11;;EC 2.6.1.14;;EC 2.3.2.7;;EC 1.14.11.n1;;EC 1.14.11.39;; |
| KEGG COMPOUND Database Links |
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| KEGG DRUG Database Links |
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| KEGG GLYCAN Database Links |
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| LIPID MAPS class Database Links |
|
| LIPID MAPS instance Database Links |
|
| Last Modified |
09 May 2014;; |
| Mass |
132.11790;; |
| MolBase Database Links |
|
| PDBeChem Database Links |
|
| Patent Database Links |
|
| PubChem Database Links |
103158355;; |
| PubMed Central Citation Links |
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| PubMed Citation Links |
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| RESID Database Links |
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| Reactome Database Links |
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| Rhea Database Links |
RHEA:37307;;RHEA:28975;;RHEA:25772;;RHEA:21016;;RHEA:19813;;RHEA:15385;;RHEA:14197;;RHEA:12324;;RHEA:12228;;RHEA:11372;;RHEA:11252;;RHEA:11180;; |
| SABIO-RK Database Links |
|
| SMILES |
NC(=O)C[C@H]([NH3+])C([O-])=O;; |
| Secondary ChEBI ID |
|
| Star |
3;; |
| Synonyms |
L-asparagine;;(2S)-4-amino-2-ammonio-4-oxobutanoate;;(2S)-2-azaniumyl-3-carbamoylpropanoate;;(2S)-2-ammonio-3-carbamoylpropanoate;; |
| UM-BBD compID Database Links |
|
| UniProt Database Links |
Q9ZSD6;;Q9ZLB9;;Q9Z4Z5;;Q9X7P0;;Q9X7E6;;Q9VXT7;;Q9V262;;Q9V251;;Q9UTS7;;Q9U518;;Q9SW96;;Q9SW95;;Q9SSK1;;Q9RRX9;;Q9PQC8;;Q9PQC6;;Q9PAF5;;Q9P6I0;;Q9LV77;;Q9LFU1;;Q9KSF9;;Q9KC78;;Q9I407;;Q9HKS7;;Q9FR37;;Q9FKS8;;Q9CN06;;Q9CKN6;;Q9CEK9;;Q99YU0;;Q98PF2;;Q97PR0; |
| ChEBI Image |
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