Dataset
![molecular Image]()
Apigenin
Chemical Info
| InChI | InChI=1S/C15H10O5/c16-9-3-1-8(2-4-9)13-7-12(19)15-11(18)5-10(17)6-14(15)20-13/h1-7,16-18H |
|---|---|
| SMILES | Oc(c3)ccc(c3)C(=C1)Oc(c2)c(c(O)cc(O)2)C(=O)1 |
| InChI Key | KZNIFHPLKGYRTM-UHFFFAOYSA-N |
| Molecular Formula | C15H10O5 |
| Exact Mass | 270.053 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-FIO00013 |
| Version | |
| Author | |
| Maintainer | |
| Language | |
| MetadataCreated | 2024-01-11T16:36:57.947295 |
| MetadataModified | 2024-01-11T16:36:58.117303 |
| MetadataPublished | 2016-01-19 |
| Field | Value |
|---|---|
| Measurement Technique | liquid chromatography-mass spectrometry |
| Measurement Variables |
| Data-Source Molecule ID | Data-Source |
|---|---|
| 48201 | Brenda |
| CB1384541 | ChemicalBook |
| 7458 | BindingDB |
| 56859 | Brenda |
| 9939 | Brenda |
| 223510 | Brenda |
| 15568 | Brenda |
| 48200 | Brenda |
| MTBLC18388 | Metabolights |
| 515 | Brenda |
| HMDB0002124 | Human Metabolome Database |
| 5280443 | PubChem |
| 60018797 | NMRShiftDB |
| PD002200 | ProbesDrugs |
| 7V515PI7F6 | FDA SRS |
| LSM-5206 | LINCS |
| 14750506 | PubChem: Thomson Pharma |
| 520-36-5 | ACToR |
| SCHEMBL19428 | SureChEMBL |
| Apigenin | Selleck |
| 461015-54-3 | ACToR |
| MCULE-6141069907 | Mcule |
| 478202 | eMolecules |
| J6.601J | Nikkaji |
| ZINC000003871576 | ZINC |
| LMPK12110005 | LipidMaps |
| DTXSID6022391 | EPA CompTox Dashboard |
| HY-N1201 | MedChemExpress |
| APIGENIN | rxnorm |
| JINJEZ | CCDC |
| 4136 | Guide to Pharmacology |
| DB07352 | DrugBank |
| AGI | PDBe |
| CHEMBL28 | ChEMBL |
| C01477 | KEGG Ligand |
| 18388 | ChEBI |
| 56310575 | PubChem: Drugs of the Future |
| The data in this table is sourced from UniChem at EBI. | |