Dataset
![molecular Image]()
Sildenafil
Chemical Info
| InChI | InChI=1S/C22H30N6O4S/c1-5-7-17-19-20(27(4)25-17)22(29)24-21(23-19)16-14-15(8-9-18(16)32-6-2)33(30,31)28-12-10-26(3)11-13-28/h8-9,14H,5-7,10-13H2,1-4H3,(H,23,24,29) |
|---|---|
| SMILES | CCOc(c4)c(cc(c4)S(=O)(=O)N(C3)CCN(C)C3)C(N1)=Nc(c(CCC)2)c(n(C)n2)C(=O)1 |
| InChI Key | BNRNXUUZRGQAQC-UHFFFAOYSA-N |
| Molecular Formula | C22H30N6O4S |
| Exact Mass | 474.205 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-WA002487 |
| Version | |
| Author | |
| Maintainer | |
| Language | |
| MetadataCreated | 2024-01-11T22:50:40.490358 |
| MetadataModified | 2024-01-11T22:50:40.675551 |
| MetadataPublished | 2016-01-19 |
| Field | Value |
|---|---|
| Measurement Technique | liquid chromatography-mass spectrometry |
| Measurement Variables |
| Data-Source Molecule ID | Data-Source |
|---|---|
| DTXSID6023579 | EPA CompTox Dashboard |
| 2441 | DrugCentral |
| 14390 | BindingDB |
| SILDENAFIL | DailyMed |
| REVATIO | rxnorm |
| SILDENAFIL | rxnorm |
| VIAGRA | rxnorm |
| SILDENAFIL CITRATE | rxnorm |
| PATREX | clinicaltrials |
| VIZARSIN | clinicaltrials |
| VIAGRA | clinicaltrials |
| UK-92,480-10 | clinicaltrials |
| UK-92480-10 | clinicaltrials |
| SILDENAFIL | clinicaltrials |
| SILDENAFIL CITRATE | clinicaltrials |
| REVATIO | clinicaltrials |
| HIP-0908 | clinicaltrials |
| HIP0908 | clinicaltrials |
| HY-15025 | MedChemExpress |
| 4743 | Guide to Pharmacology |
| J897.167F | Nikkaji |
| 50238854 | BindingDB |
| QEGTUT | CCDC |
| CHEMBL192 | ChEMBL |
| C07259 | KEGG Ligand |
| VIA | PDBe |
| CB2747316 | ChemicalBook |
| sildenafil | DailyMed |
| HMDB0005039 | Human Metabolome Database |
| DB00203 | DrugBank |
| CB82675677 | ChemicalBook |
| ZINC000019796168 | ZINC |
| 615 | Brenda |
| 117589 | Brenda |
| 135398744 | PubChem |
| 14883184 | PubChem: Thomson Pharma |
| PD003443 | ProbesDrugs |
| 3M7OB98Y7H | FDA SRS |
| LSM-3797 | LINCS |
| 14834479 | PubChem: Thomson Pharma |
| SCHEMBL1895 | SureChEMBL |
| PA451346 | PharmGKB |
| 139755-83-2 | ACToR |
| MCULE-2481702478 | Mcule |
| 9139 | ChEBI |
| 902463 | eMolecules |
| The data in this table is sourced from UniChem at EBI. | |