Dataset

Fenofibric acid

This MassBank record with Accession MSBNK-Athens_Univ-AU205603 contains the MS2 mass spectrum of Fenofibric acid with the InChIkey MQOBSOSZFYZQOK-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C17H15ClO4/c1-17(2,16(20)21)22-14-9-5-12(6-10-14)15(19)11-3-7-13(18)8-4-11/h3-10H,1-2H3,(H,20,21)
SMILES CC(C)(OC1=CC=C(C=C1)C(=O)C1=CC=C(Cl)C=C1)C(O)=O
InChI Key MQOBSOSZFYZQOK-UHFFFAOYSA-N
Molecular Formula C17H15ClO4
Exact Mass 318.066 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-Athens_Univ-AU205603
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T09:45:28.815489
MetadataModified 2024-01-11T09:45:28.988845
MetadataPublished 2015-12-04
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
DTXSID8041030 EPA CompTox Dashboard
MCULE-1938576029 Mcule
ZINC000000001984 ZINC
28700 BindingDB
F5A PDBe
FENOFIBRIC ACID DailyMed
FIBRICOR rxnorm
TRILIPIX rxnorm
CHOLINE FENOFIBRATE rxnorm
FENOFIBRIC ACID rxnorm
TRILIPIX clinicaltrials
FIBRICOR clinicaltrials
ABT-335 clinicaltrials
FENOFIBRIC ACID clinicaltrials
CHOLINE FENOFIBRATE clinicaltrials
HY-B0760 MedChemExpress
4505 DrugCentral
2662 Guide to Pharmacology
MTBLC83469 Metabolights
fenofibric acid DailyMed
CB8400259 ChemicalBook
49052 Brenda
DB13873 DrugBank
15988368 PubChem: Thomson Pharma
42017-89-0 ACToR
PD001159 ProbesDrugs
BGF9MN2HU1 FDA SRS
SCHEMBL16377 SureChEMBL
QANHUJ CCDC
83469 ChEBI
HMDB0252207 Human Metabolome Database
J22.637H Nikkaji
64929 PubChem
CHEMBL981 ChEMBL
591140 eMolecules
The data in this table is sourced from UniChem at EBI.