Dataset
![molecular Image]()
Fisetin
Chemical Info
| InChI | InChI=1S/C15H10O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,16-18,20H |
|---|---|
| SMILES | Oc(c3)cc(O1)c(c3)C(=O)C(O)=C1c(c2)cc(O)c(O)c2 |
| InChI Key | XHEFDIBZLJXQHF-UHFFFAOYSA-N |
| Molecular Formula | C15H10O6 |
| Exact Mass | 286.048 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-Fiocruz-FIO00090 |
| Version | |
| Author | |
| Maintainer | |
| Language | |
| MetadataCreated | 2024-01-11T16:35:25.233164 |
| MetadataModified | 2024-01-11T16:35:25.408040 |
| MetadataPublished | 2016-01-19 |
| Field | Value |
|---|---|
| Measurement Technique | liquid chromatography-mass spectrometry |
| Measurement Variables |
| Data-Source Molecule ID | Data-Source |
|---|---|
| LSM-6579 | LINCS |
| fisetin | Atlas |
| OO2ABO9578 | FDA SRS |
| FISETIN | clinicaltrials |
| PD001338 | ProbesDrugs |
| 528-48-3 | ACToR |
| 14922300 | PubChem: Thomson Pharma |
| Fisetin(Fustel) | Selleck |
| 110309 | Brenda |
| CB8451569 | ChemicalBook |
| 156717 | Brenda |
| MTBLC42567 | Metabolights |
| 1257 | Brenda |
| 125032 | Brenda |
| SCHEMBL39454 | SureChEMBL |
| 42567 | ChEBI |
| MCULE-8216354240 | Mcule |
| 20096805 | NMRShiftDB |
| 5281614 | PubChem |
| 711423 | eMolecules |
| J1.584I | Nikkaji |
| 7457 | BindingDB |
| LMPK12111566 | LipidMaps |
| ZINC000000039111 | ZINC |
| 5182 | Guide to Pharmacology |
| DTXSID4022317 | EPA CompTox Dashboard |
| 92074 | Brenda |
| HY-N0182 | MedChemExpress |
| JOPVAN | CCDC |
| DB07795 | DrugBank |
| C10041 | KEGG Ligand |
| CHEMBL31574 | ChEMBL |
| FSE | PDBe |
| 12015309 | PubChem: Drugs of the Future |
| The data in this table is sourced from UniChem at EBI. | |