| Number |
mr1327 |
| Declustering Potential(DP) |
10 |
| Collision Energy(CE) |
20 |
| Observed mass(Da) |
|
| Exact mass(Da) |
|
| Accurate mass error(ppm) |
|
| Molecular formula |
|
| Ionization model |
|
| Ret. Time(min) |
1.57 |
| Precursor ions(Q1) |
134.1 |
| Product ions(Q3) |
88.1 |
| Main fragments |
88.1, 116.1, 74.1, 70.0, 68.0 |
| Compound |
L-Aspartic acid |
| Identification |
standard |
| class |
Amino acid |
| Organism |
|
| Reference |
|
| CV(%) |
37.18 |
| H2 |
0.29 |
| ChEBI_ID |
CHEBI:29958 |
| Agricola Citation Links |
|
| ArrayExpress Database Links |
|
| BRAND Names |
|
| Beilstein Registry Numbers |
|
| BioModels Database Links |
|
| CAS Registry Numbers |
|
| COMe Database Links |
|
| ChEBI ID |
|
| ChEBI Name |
L-aspartic acid residue;; |
| Charge |
0;; |
| Chinese Abstracts Citation Links |
|
| CiteXplore Citation Links |
|
| Definition |
|
| DrugBank Database Links |
|
| Formulae |
C4H5NO3;; |
| Gmelin Registry Numbers |
|
| INN |
|
| IUPAC Names |
|
| InChI |
|
| InChIKey |
|
| IntAct Database Links |
|
| IntEnz Database Links |
|
| KEGG COMPOUND Database Links |
|
| KEGG DRUG Database Links |
|
| KEGG GLYCAN Database Links |
|
| LIPID MAPS class Database Links |
|
| LIPID MAPS instance Database Links |
|
| Last Modified |
27 Jul 2015;; |
| Mass |
115.08744;; |
| MolBase Database Links |
|
| PDBeChem Database Links |
|
| Patent Database Links |
|
| PubChem Database Links |
8146397;; |
| PubMed Central Citation Links |
|
| PubMed Citation Links |
|
| RESID Database Links |
AA0004;; |
| Reactome Database Links |
|
| Rhea Database Links |
|
| SABIO-RK Database Links |
9604;;923;;922;;920;;917;;912;;9;;858;;827;;825;;7821;;7742;;7741;;766;;572;;402;;398;;3428;;3220;;228;;1841;;1825;;150;;13905;;13450;;13449;;13448;;13447;;13446;;13435;;13434;;13284;;13275;;13274;;13244;;13216;;13138;;12820;;12819;;12418;;12417;;12390;;1 |
| SMILES |
|
| Secondary ChEBI ID |
|
| Star |
3;; |
| Synonyms |
L-aspartyl;;L-aspartic residue;;L-aspartic acid residue;;L-aspartic acid;;D;;Asp;;-Asp-;; |
| UM-BBD compID Database Links |
|
| UniProt Database Links |
Q9ZWS9;;Q9ZWS7;;Q9ZWS6;;Q9ZWL6;;Q9ZWJ9;;Q9ZVX1;;Q9ZVD3;;Q9ZUH4;;Q9ZTP3;;Q9ZSD6;;Q9ZR14;;Q9ZNV9;;Q9ZNV8;;Q9ZNT9;;Q9ZMF4;;Q9ZLH6;;Q9ZL11;;Q9ZKM6;;Q9ZKC2;;Q9ZGM0;;Q9ZE11;;Q9ZE09;;Q9ZDB9;;Q9ZCK8;;Q9Z9X0;;Q9Z9L9;;Q9Z9G8;;Q9Z9G6;;Q9Z8W5;;Q9Z581;;Q9Z578;;Q9Z330; |
| ChEBI Image |
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| |
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