Dataset
![molecular Image]()
L-Asparagine
Chemical Info
| 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 |
|---|---|
| SMILES | C([C@@H](C(=O)O)N)C(=N)O |
| InChI Key | DCXYFEDJOCDNAF-REOHCLBHSA-N |
| Molecular Formula | C4H8N2O3 |
| Exact Mass | 132.053 g/mol |
Data and Resources
Metadata Information
| Field | Value |
|---|---|
| DOI | |
| License URL | https://creativecommons.org/licenses/by/4.0 |
| Source | https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-BGC_Munich-RP001511 |
| Version | |
| Author | |
| Maintainer | |
| Language | |
| MetadataCreated | 2024-01-11T12:32:12.428869 |
| MetadataModified | 2025-02-08T21:14:52.197401 |
| MetadataPublished | 2017-10-20 |
| Related Molecule |
| Field | Value |
|---|---|
| Measurement Technique | liquid chromatography-mass spectrometry |
| Measurement Variables |
| Data-Source Molecule ID | Data-Source |
|---|---|
| PD010188 | ProbesDrugs |
| 6267 | PubChem |
| 60018671 | NMRShiftDB |
| 14747678 | PubChem: Thomson Pharma |
| 15119952 | PubChem: Thomson Pharma |
| asn_L | Recon |
| 32640-57-6 | ACToR |
| 478690 | eMolecules |
| MCULE-1868046141 | Mcule |
| 6992089 | PubChem |
| SCHEMBL8827 | SureChEMBL |
| MTBLC17196 | Metabolights |
| 266 | Brenda |
| 840 | Brenda |
| 136825 | Brenda |
| 1506 | Brenda |
| 2264 | Brenda |
| 5Z33R5TKO7 | FDA SRS |
| HMDB0000168 | Human Metabolome Database |
| 58048 | Rhea |
| DTXSID10883220 | EPA CompTox Dashboard |
| CB4375647 | ChemicalBook |
| asparagine | DailyMed |
| 181137 | BindingDB |
| MTBLC58048 | Metabolights |
| PA164776968 | PharmGKB |
| 58048 | ChEBI |
| DB00174 | DrugBank |
| C00152 | KEGG Ligand |
| 17196 | ChEBI |
| CHEMBL58832 | ChEMBL |
| 229565 | Brenda |
| ASPARAGINE | DailyMed |
| ASPARAGINE | rxnorm |
| ASPARAGINE | clinicaltrials |
| HY-N0667 | MedChemExpress |
| VIKKEG | CCDC |
| 41Q | PDBe |
| 4126 | DrugCentral |
| ZINC000001532556 | ZINC |
| 4533 | Guide to Pharmacology |
| J9.178B | Nikkaji |
| ASN | PDBe |
| The data in this table is sourced from UniChem at EBI. | |