Dataset
![molecular Image]()
Prednisone
Chemical Info
| InChI | InChI=1S/C21H26O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h5,7,9,14-15,18,22,26H,3-4,6,8,10-11H2,1-2H3/t14-,15-,18+,19-,20-,21-/m0/s1 |
|---|---|
| SMILES | OCC(=O)C(O)(C4)C(C)(C3)C([H])(C4)C([H])(C1)C([H])(C(=O)3)C(C)(C=2)C(=CC(=O)C2)C1 |
| InChI Key | XOFYZVNMUHMLCC-ZPOLXVRWSA-N |
| Molecular Formula | C21H26O5 |
| Exact Mass | 358.178 g/mol |
Data and Resources
Metadata Information
| Field | Value |
|---|---|
| DOI | |
| License URL | https://creativecommons.org/licenses/by-nc/4.0 |
| Source | https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Waters-WA002455 |
| Version | |
| Author | |
| Maintainer | |
| Language | |
| MetadataCreated | 2024-01-11T22:47:48.944170 |
| MetadataModified | 2024-01-11T22:47:49.101043 |
| MetadataPublished | 2016-01-19 |
| Field | Value |
|---|---|
| Measurement Technique | liquid chromatography-mass spectrometry |
| Measurement Variables |
| Data-Source Molecule ID | Data-Source |
|---|---|
| C07370 | KEGG Ligand |
| DB00635 | DrugBank |
| CHEMBL635 | ChEMBL |
| SAM002264641 | NIH Clinical Collection |
| 8382 | ChEBI |
| 125299297 | PubChem: Drugs of the Future |
| 29703823 | eMolecules |
| 29549912 | eMolecules |
| 494851 | eMolecules |
| 31411020 | eMolecules |
| 14901277 | PubChem: Thomson Pharma |
| 5865 | PubChem |
| PD002901 | ProbesDrugs |
| VB0R961HZT | FDA SRS |
| LSM-24953 | LINCS |
| PA451100 | PharmGKB |
| Prednisone | Selleck |
| 14876665 | PubChem: Thomson Pharma |
| 7096 | Guide to Pharmacology |
| J4.137H | Nikkaji |
| SCHEMBL3288 | SureChEMBL |
| MCULE-2603291254 | Mcule |
| DTXSID4021185 | EPA CompTox Dashboard |
| HY-B0214 | MedChemExpress |
| ZINC000003875357 | ZINC |
| 2253 | DrugCentral |
| LMST02030180 | LipidMaps |
| PREDNISONE | DailyMed |
| PREDNISONE INTENSOL | clinicaltrials |
| PREDNISONE | rxnorm |
| RAYOS | rxnorm |
| DELTASONE | rxnorm |
| PRGDOL | CCDC |
| DELTASONE | clinicaltrials |
| NSC-10023 | clinicaltrials |
| PREDNISONE | clinicaltrials |
| CB44844383 | ChemicalBook |
| PREDNISONE TABLETS | clinicaltrials |
| DECORTIN | clinicaltrials |
| prednisone | DailyMed |
| CB6716222 | ChemicalBook |
| 90421 | Brenda |
| HMDB0014773 | Human Metabolome Database |
| 90706 | Brenda |
| 145980 | Brenda |
| 104334 | Brenda |
| 90423 | Brenda |
| 44723 | Brenda |
| 145066 | Brenda |
| The data in this table is sourced from UniChem at EBI. | |