Dataset
![molecular Image]()
Enzalutamide
Chemical Info
| InChI | InChI=1S/C21H16F4N4O2S/c1-20(2)18(31)28(12-5-4-11(10-26)15(8-12)21(23,24)25)19(32)29(20)13-6-7-14(16(22)9-13)17(30)27-3/h4-9H,1-3H3,(H,27,30) |
|---|---|
| SMILES | CC1(C(=O)N(C(=S)N1C2=CC(=C(C=C2)C(=O)NC)F)C3=CC(=C(C=C3)C#N)C(F)(F)F)C |
| InChI Key | WXCXUHSOUPDCQV-UHFFFAOYSA-N |
| Molecular Formula | C21H16F4N4O2S |
| Exact Mass | 464.093 g/mol |
Data and Resources
Metadata Information
| Field | Value |
|---|---|
| DOI | |
| License URL | https://creativecommons.org/licenses/by-sa/4.0 |
| Source | https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Eawag-EQ01104105 |
| Version | |
| Author | |
| Maintainer | |
| Language | |
| MetadataCreated | 2025-02-09T10:05:49.713058 |
| MetadataModified | 2025-02-09T10:05:49.921374 |
| MetadataPublished | 2024-06-14 |
| Related Molecule |
| Field | Value |
|---|---|
| Measurement Technique | liquid chromatography-mass spectrometry |
| Measurement Variables |
| Data-Source Molecule ID | Data-Source |
|---|---|
| CB62500946 | ChemicalBook |
| ZINC000034806477 | ZINC |
| enzalutamide | DailyMed |
| SCHEMBL189749 | SureChEMBL |
| 15951529 | PubChem |
| PD004101 | ProbesDrugs |
| HC-1119 | clinicaltrials |
| HC1119 | clinicaltrials |
| DB08899 | DrugBank |
| 93T0T9GKNU | FDA SRS |
| LSM-6254 | LINCS |
| MDV3100 | Selleck |
| 22422973 | PubChem: Thomson Pharma |
| 68534 | ChEBI |
| 32176540 | eMolecules |
| HMDB0251831 | Human Metabolome Database |
| 6812 | Guide to Pharmacology |
| XTANDI | rxnorm |
| ENZALUTAMIDE | clinicaltrials |
| XTANDI | clinicaltrials |
| MDV-3100 | clinicaltrials |
| MDV3100 | clinicaltrials |
| ENZALUTAMIDE | DailyMed |
| YEXGEQ | CCDC |
| 4628 | DrugCentral |
| ENZALUTAMIDE | rxnorm |
| HY-70002 | MedChemExpress |
| J2.922.494C | Nikkaji |
| 50425732 | BindingDB |
| 125299336 | PubChem: Drugs of the Future |
| CHEMBL1082407 | ChEMBL |
| The data in this table is sourced from UniChem at EBI. | |