Dataset
![molecular Image]()
1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
Chemical Info
| InChI | InChI=1S/C3H7NO3/c4-2(1-5)3(6)7/h2,5H,1,4H2,(H,6,7)/t2-/m0/s1 |
|---|---|
| SMILES | OC[C@@H](C(=O)O)N |
| InChI Key | MTCFGRXMJLQNBG-REOHCLBHSA-N |
| Molecular Formula | C3H7NO3 |
| Exact Mass | 105.093 g/mol |
Data and Resources
Metadata Information
| Field | Value |
|---|---|
| DOI | 10.14272/MTCFGRXMJLQNBG-REOHCLBHSA-N/CHMO0001148 |
| License URL | |
| Source | https://www.chemotion-repository.net/inchikey/MTCFGRXMJLQNBG-REOHCLBHSA-N/CHMO0001148 |
| Version | |
| Author | Jana Alpin |
| Maintainer | Chemotion Repository |
| Language | english |
| MetadataCreated | 2024-09-08T04:33:44.189163 |
| MetadataModified | 2024-09-08T04:33:44.189169 |
| MetadataPublished | 2024-08-26 |
| Field | Value |
|---|---|
| Measurement Technique | 1H–13C heteronuclear multiple bond coherence |
| Measurement Variables |
| Data-Source Molecule ID | Data-Source |
|---|---|
| C00065 | KEGG Ligand |
| DB00133 | DrugBank |
| CHEMBL11298 | ChEMBL |
| 726 | Guide to Pharmacology |
| 33384 | ChEBI |
| 17115 | ChEBI |
| SER | PDBe |
| SERINE | DailyMed |
| SERINE | clinicaltrials |
| LSERIN | CCDC |
| MCULE-5604658333 | Mcule |
| J1.195I | Nikkaji |
| SCHEMBL1775 | SureChEMBL |
| 4127 | DrugCentral |
| L-SERINE | clinicaltrials |
| ZINC000000895034 | ZINC |
| SERINE | rxnorm |
| 60006048 | NMRShiftDB |
| HY-N0650 | MedChemExpress |
| 262 | Brenda |
| 35658 | Brenda |
| HMDB0000187 | Human Metabolome Database |
| 33384 | Rhea |
| CB5673304 | ChemicalBook |
| DTXSID60883230 | EPA CompTox Dashboard |
| serine | DailyMed |
| 50357212 | BindingDB |
| MTBLC33384 | Metabolights |
| MTBLC17115 | Metabolights |
| PA451330 | PharmGKB |
| 95 | Brenda |
| 145040 | Brenda |
| 145952 | Brenda |
| 930 | Brenda |
| 870 | Brenda |
| PD010212 | ProbesDrugs |
| 452VLY9402 | FDA SRS |
| ser_L | Recon |
| 15119722 | PubChem: Thomson Pharma |
| 16532479 | PubChem: Thomson Pharma |
| 25821-52-7 | ACToR |
| 6857581 | PubChem |
| 5951 | PubChem |
| MCULE-6118038121 | Mcule |
| 514205 | eMolecules |
| The data in this table is sourced from UniChem at EBI. | |