| Number |
qtl-m0036 |
| Declustering Potential(DP) |
30 |
| Collision Energy(CE) |
20 |
| Observed mass(Da) |
|
| Exact mass(Da) |
|
| Accurate mass error(ppm) |
|
| Molecular formula |
|
| Ionization model |
|
| Ret. Time(min) |
|
| Precursor ions(Q1) |
156.1 |
| Product ions(Q3) |
110.1 |
| Main fragments |
110.1, 93.1, 83.1, 67.4 |
| Compound |
L-Histidine |
| Identification |
standard |
| class |
Amino acid |
| Organism |
|
| Reference |
|
| CV(%) |
|
| H2 |
|
| ChEBI_ID |
CHEBI:57595 |
| 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-histidine zwitterion;; |
| Charge |
0;; |
| Chinese Abstracts Citation Links |
|
| CiteXplore Citation Links |
|
| Definition |
Zwitterionic form of L-histidine having an anionic carboxy group and a protonated alpha-amino group.;; |
| DrugBank Database Links |
|
| Formulae |
C6H9N3O2;; |
| Gmelin Registry Numbers |
663322;; |
| INN |
|
| IUPAC Names |
(2S)-2-azaniumyl-3-(1H-imidazol-4-yl)propanoate;; |
| InChI |
InChI=1S/C6H9N3O2/c7-5(6(10)11)1-4-2-8-3-9-4/h2-3,5H,1,7H2,(H,8,9)(H,10,11)/t5-/m0/s1;; |
| InChIKey |
HNDVDQJCIGZPNO-YFKPBYRVSA-N;; |
| IntAct Database Links |
|
| IntEnz Database Links |
EC 6.3.2.11;;EC 6.1.1.21;;EC 4.3.1.3;;EC 4.1.1.22;;EC 2.6.1.38;;EC 2.3.1.33;;EC 2.1.1.44;;EC 1.14.99.52;;EC 1.1.1.23;; |
| KEGG COMPOUND Database Links |
|
| KEGG DRUG Database Links |
|
| KEGG GLYCAN Database Links |
|
| LIPID MAPS class Database Links |
|
| LIPID MAPS instance Database Links |
|
| Last Modified |
24 Oct 2014;; |
| Mass |
155.15460;; |
| MolBase Database Links |
|
| PDBeChem Database Links |
|
| Patent Database Links |
|
| PubChem Database Links |
99319270;; |
| PubMed Central Citation Links |
|
| PubMed Citation Links |
|
| RESID Database Links |
|
| Reactome Database Links |
|
| Rhea Database Links |
RHEA:42676;;RHEA:38475;;RHEA:38471;;RHEA:37283;;RHEA:37047;;RHEA:33803;;RHEA:29891;;RHEA:24596;;RHEA:21232;;RHEA:20840;;RHEA:20641;;RHEA:19297;;RHEA:17313;;RHEA:16565;; |
| SABIO-RK Database Links |
|
| SMILES |
[NH3+][C@@H](Cc1c[nH]cn1)C([O-])=O;; |
| Secondary ChEBI ID |
|
| Star |
3;; |
| Synonyms |
L-histidine;;(2S)-2-ammonio-3-(1H-imidazol-4-yl)propanoate;; |
| UM-BBD compID Database Links |
|
| UniProt Database Links |
Q9ZWL6;;Q9ZK27;;Q9ZHE7;;Q9ZHE6;;Q9ZHE5;;Q9ZHE4;;Q9ZHE3;;Q9ZHE2;;Q9ZHE1;;Q9ZHE0;;Q9ZHD4;;Q9ZGM1;;Q9ZGM0;;Q9ZEP3;;Q9ZDL9;;Q9ZCU7;;Q9ZC74;;Q9ZAD8;;Q9Z9E3;;Q9Z7P1;;Q9Z5G7;;Q9Z472;;Q9Z471;;Q9YH58;;Q9YEB2;;Q9XH58;;Q9XH57;;Q9X7C3;;Q9X7C2;;Q9X7C0;;Q9X7B9;;Q9X7B8; |
| ChEBI Image |
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