DIFLORASONE DIACETATE

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Trade Names
Synonyms
Status
Molecule Category Free-form
UNII 7W2J09SCWX
EPA CompTox DTXSID8045646

Structure

InChI Key BOBLHFUVNSFZPJ-JOYXJVLSSA-N
Smiles CC(=O)OCC(=O)[C@@]1(OC(C)=O)[C@@H](C)C[C@H]2[C@@H]3C[C@H](F)C4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@@]21C
InChI
InChI=1S/C26H32F2O7/c1-13-8-17-18-10-20(27)19-9-16(31)6-7-23(19,4)25(18,28)21(32)11-24(17,5)26(13,35-15(3)30)22(33)12-34-14(2)29/h6-7,9,13,17-18,20-21,32H,8,10-12H2,1-5H3/t13-,17-,18-,20-,21-,23-,24-,25-,26-/m0/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C26H32F2O7
Molecular Weight 494.53
AlogP 2.99
Hydrogen Bond Acceptor 7.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 4.0
Polar Surface Area 106.97
Molecular species NEUTRAL
Aromatic Rings 0.0
Heavy Atoms 35.0

Pharmacology

Mechanism of Action Action Reference
Glucocorticoid receptor agonist AGONIST PubMed

Target Conservation

Protein: Glucocorticoid receptor
Description: Glucocorticoid receptor
Organism : Homo sapiens
P04150 ENSG00000113580

Cross References

Resources Reference
ChEBI 31483
ChEMBL CHEMBL1200545
DrugCentral 4485
FDA SRS 7W2J09SCWX
Guide to Pharmacology 7068
PharmGKB PA164749408
PubChem 71414
SureChEMBL SCHEMBL4556
ZINC ZINC000004212938
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