Dataset
Felbinac
Chemical Info
InChI | InChI=1S/C14H12O2/c15-14(16)10-11-6-8-13(9-7-11)12-4-2-1-3-5-12/h1-9H,10H2,(H,15,16) |
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SMILES | C1=CC=C(C=C1)C2=CC=C(C=C2)CC(=O)O |
InChI Key | QRZAKQDHEVVFRX-UHFFFAOYSA-N |
Molecular Formula | C14H12O2 |
Exact Mass | 212.084 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-EQ01162707 |
Version | |
Author | |
Maintainer | |
Language | |
MetadataCreated | 2025-02-09T09:57:35.228941 |
MetadataModified | 2025-02-09T09:57:35.393036 |
MetadataPublished | 2024-01-16 |
Related Molecule |
Field | Value |
---|---|
Measurement Technique | liquid chromatography-mass spectrometry |
Measurement Variables |
Data-Source Molecule ID | Data-Source |
---|---|
TRAXAM | clinicaltrials |
FELBINAC | clinicaltrials |
HY-B0641 | MedChemExpress |
KUZWEI | CCDC |
HMDB0246378 | Human Metabolome Database |
DTXSID0045389 | EPA CompTox Dashboard |
ZINC000000002318 | ZINC |
1141 | DrugCentral |
J105.145H | Nikkaji |
FELBINAC | rxnorm |
CHEMBL413965 | ChEMBL |
12013864 | PubChem: Drugs of the Future |
31597 | ChEBI |
BP4 | PDBe |
DB07477 | DrugBank |
PD000177 | ProbesDrugs |
94WNJ5U8L7 | FDA SRS |
15171954 | PubChem: Thomson Pharma |
5728-52-9 | ACToR |
LSM-5965 | LINCS |
487487 | eMolecules |
PA166049177 | PharmGKB |
CB0186272 | ChemicalBook |
223312 | BindingDB |
54683 | Brenda |
MCULE-4188902854 | Mcule |
SCHEMBL26084 | SureChEMBL |
3332 | PubChem |
The data in this table is sourced from UniChem at EBI. |