Dataset
![molecular Image]()
Terfenadine
Chemical Info
| InChI | InChI=1S/C32H41NO2/c1-31(2,3)26-18-16-25(17-19-26)30(34)15-10-22-33-23-20-29(21-24-33)32(35,27-11-6-4-7-12-27)28-13-8-5-9-14-28/h4-9,11-14,16-19,29-30,34-35H,10,15,20-24H2,1-3H3 |
|---|---|
| SMILES | C(c(c4)cccc4)(c(c3)cccc3)(C(C2)CCN(C2)CCCC(O)c(c1)ccc(C(C)(C)C)c1)O |
| InChI Key | GUGOEEXESWIERI-UHFFFAOYSA-N |
| Molecular Formula | C32H41NO2 |
| Exact Mass | 471.314 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-WA000470 |
| Version | |
| Author | |
| Maintainer | |
| Language | |
| MetadataCreated | 2024-01-11T22:34:39.522438 |
| MetadataModified | 2025-02-09T20:21:40.437275 |
| MetadataPublished | 2016-01-19 |
| Related Molecule |
| Field | Value |
|---|---|
| Measurement Technique | liquid chromatography-mass spectrometry |
| Measurement Variables |
| Data-Source Molecule ID | Data-Source |
|---|---|
| DB00342 | DrugBank |
| 2608 | Guide to Pharmacology |
| CHEMBL17157 | ChEMBL |
| C07463 | KEGG Ligand |
| 12013836 | PubChem: Drugs of the Future |
| 9453 | ChEBI |
| 7BA5G9Y06Q | FDA SRS |
| HY-B1193 | MedChemExpress |
| TERFENADINE | clinicaltrials |
| TERFENADINE | rxnorm |
| MCULE-8216311776 | Mcule |
| 50017376 | BindingDB |
| DTXSID2023642 | EPA CompTox Dashboard |
| 2600 | DrugCentral |
| 230136 | Brenda |
| J434.879F | Nikkaji |
| 230135 | Brenda |
| J9.749G | Nikkaji |
| CB7695393 | ChemicalBook |
| 595223 | eMolecules |
| 5405 | PubChem |
| PD000887 | ProbesDrugs |
| LSM-1273 | LINCS |
| 14907543 | PubChem: Thomson Pharma |
| 50679-08-8 | ACToR |
| PA451619 | PharmGKB |
| SCHEMBL5152 | SureChEMBL |
| HMDB0014486 | Human Metabolome Database |
| 36985 | Brenda |
| The data in this table is sourced from UniChem at EBI. | |