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2D Structure
Also known as: Decoderm, 1255-35-2, 9-fluoro-11beta,17,21-trihydroxy-16-methylenepregna-1,4-diene-3,20-dione 21-acetate, Ge65dv564s, Emecort, Fluprednidene 21-acetate
Molecular Formula
C24H29FO6
Molecular Weight
432.5  g/mol
InChI Key
DEFOZIFYUBUHHU-IYQKUMFPSA-N
FDA UNII
GE65DV564S

Fluprednidene acetate is a corticosteroid. It has anti-inflammatory and anti-allergic properties.
1 2D Structure

2D Structure

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
[2-[(8S,9R,10S,11S,13S,14S,17R)-9-fluoro-11,17-dihydroxy-10,13-dimethyl-16-methylidene-3-oxo-7,8,11,12,14,15-hexahydro-6H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl] acetate
2.1.2 InChI
InChI=1S/C24H29FO6/c1-13-9-18-17-6-5-15-10-16(27)7-8-21(15,3)23(17,25)19(28)11-22(18,4)24(13,30)20(29)12-31-14(2)26/h7-8,10,17-19,28,30H,1,5-6,9,11-12H2,2-4H3/t17-,18-,19-,21-,22-,23-,24-/m0/s1
2.1.3 InChI Key
DEFOZIFYUBUHHU-IYQKUMFPSA-N
2.1.4 Canonical SMILES
CC(=O)OCC(=O)C1(C(=C)CC2C1(CC(C3(C2CCC4=CC(=O)C=CC43C)F)O)C)O
2.1.5 Isomeric SMILES
CC(=O)OCC(=O)[C@]1(C(=C)C[C@@H]2[C@@]1(C[C@@H]([C@]3([C@H]2CCC4=CC(=O)C=C[C@@]43C)F)O)C)O
2.2 Other Identifiers
2.2.1 UNII
GE65DV564S
2.3 Synonyms
2.3.1 MeSH Synonyms

1. Decoderm

2. Fluprednylidene Acetate

2.3.2 Depositor-Supplied Synonyms

1. Decoderm

2. 1255-35-2

3. 9-fluoro-11beta,17,21-trihydroxy-16-methylenepregna-1,4-diene-3,20-dione 21-acetate

4. Ge65dv564s

5. Emecort

6. Fluprednidene 21-acetate

7. Unii-ge65dv564s

8. Decoderm (tn)

9. Einecs 215-013-9

10. Schembl7333

11. Chebi:135700

12. Fluprednidene Acetate [mi]

13. Zinc30691649

14. Fluprednidene Acetate [mart.]

15. Fluprednidene Acetate [who-dd]

16. Db14634

17. [2-[(8s,9r,10s,11s,13s,14s,17r)-9-fluoro-11,17-dihydroxy-10,13-dimethyl-16-methylidene-3-oxo-7,8,11,12,14,15-hexahydro-6h-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl] Acetate

18. D07980

19. J-005237

20. 9-fluoro-11beta,17,21-trihydroxy-16-methylenepregna-1,4-diene-3,20-dione21-acetate

2.4 Create Date
2006-10-25
3 Chemical and Physical Properties
Molecular Weight 432.5 g/mol
Molecular Formula C24H29FO6
XLogP32.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count4
Exact Mass432.19481680 g/mol
Monoisotopic Mass432.19481680 g/mol
Topological Polar Surface Area101 Ų
Heavy Atom Count31
Formal Charge0
Complexity952
Isotope Atom Count0
Defined Atom Stereocenter Count7
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1
4 Pharmacology and Biochemistry
4.1 MeSH Pharmacological Classification

Glucocorticoids

A group of CORTICOSTEROIDS that affect carbohydrate metabolism (GLUCONEOGENESIS, liver glycogen deposition, elevation of BLOOD SUGAR), inhibit ADRENOCORTICOTROPIC HORMONE secretion, and possess pronounced anti-inflammatory activity. They also play a role in fat and protein metabolism, maintenance of arterial blood pressure, alteration of the connective tissue response to injury, reduction in the number of circulating lymphocytes, and functioning of the central nervous system. (See all compounds classified as Glucocorticoids.)