Atovaquone

Basic Information

CAS ID: 95233-18-4
Molecular Formula: C22H19ClO3
Molecular Weight: 366.8 g/mol
Monoisotopic Mass: 366.1023 g/mol
Class: Small Molecule
Natural Product: No
Other Names: WELLVONE | ATOVAQUONE | 566C | MEPRON | 566C80
Analysis: Drug repositioning mechanism analysis

OH Cl O O

Compound Structure and Identifier

InChI: InChI=1S/C22H19ClO3/c23-16-11-9-14(10-12-16)13-5-7-15(8-6-13)19-20(24)17-3-1-2-4-18(17)21(25)22(19)26/h1-4,9-13,15,26H,5-8H2/t13-,15- See All
InChI Key: KUCQYCKVKVOKAY-CTYIDZIISA-N
Smiles: OC1=C([C@@H]2CC[C@H](CC2)c3ccc(Cl)cc3)C(=O)c4ccccc4C1=O See All
Molfile: Download

Related Target

Related Fibrosis Property

Trial Record 1

ClinicalTrial ID NCT00636935 Disease Pulmonary fibrosis
Phase Phase 4 Status Withdrawn
First Received March 17, 2008 Last Verified June 27, 2017
Sponsor George Washington University

Related Link

PubChem: 74989
ChEMBL: CHEMBL1450