Dataset
![molecular Image]()
Tiapride
Chemical Info
| InChI | InChI=1S/C15H24N2O4S/c1-5-17(6-2)10-9-16-15(18)13-11-12(22(4,19)20)7-8-14(13)21-3/h7-8,11H,5-6,9-10H2,1-4H3,(H,16,18) |
|---|---|
| SMILES | CCN(CC)CCNC(=O)c(c(OC)1)cc(cc1)S(C)(=O)=O |
| InChI Key | JTVPZMFULRWINT-UHFFFAOYSA-N |
| Molecular Formula | C15H24N2O4S |
| Exact Mass | 328.146 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-WA002159 |
| Version | |
| Author | |
| Maintainer | |
| Language | |
| MetadataCreated | 2024-01-11T22:35:45.272469 |
| MetadataModified | 2025-02-09T20:27:07.911651 |
| MetadataPublished | 2016-01-19 |
| Related Molecule |
| Field | Value |
|---|---|
| Measurement Technique | liquid chromatography-mass spectrometry |
| Measurement Variables |
| Data-Source Molecule ID | Data-Source |
|---|---|
| CHEMBL84158 | ChEMBL |
| TIAPRIDE | rxnorm |
| TIAPRIDAL | clinicaltrials |
| TIAPRIDE HYDROCHLORIDE | clinicaltrials |
| TIAPRIDE | clinicaltrials |
| 82073 | BindingDB |
| MCULE-5546780960 | Mcule |
| 94666 | ChEBI |
| ZINC000001542927 | ZINC |
| DB13025 | DrugBank |
| J11.205D | Nikkaji |
| BUFCOU | CCDC |
| DTXSID0023664 | EPA CompTox Dashboard |
| 2651 | DrugCentral |
| 20207532 | NMRShiftDB |
| SCHEMBL34750 | SureChEMBL |
| 75629 | Brenda |
| HMDB0042039 | Human Metabolome Database |
| 14753076 | PubChem: Thomson Pharma |
| 5467 | PubChem |
| PD013238 | ProbesDrugs |
| LSM-5676 | LINCS |
| 51012-32-9 | ACToR |
| LAH70H9JPH | FDA SRS |
| 594579 | eMolecules |
| The data in this table is sourced from UniChem at EBI. | |