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Fluorometholone Acetate

CAT: 0572-TRC-F593150-50MGSize: 50 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-F593150-50MGSize:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
3801-06-7
Synonyms
Pregna-1,4-diene-3,20-dione, 9-fluoro-11β,17-dihydroxy-6α-methyl-, 17-acetate (6CI,7CI,8CI); (6α,11β)-17-(Acetyloxy)-9-fluoro-11-hydroxy-6-methylpregna-1,4-diene-3,20-dione; 6α-Methyl-9α-fluoro-17-acetoxy-21-deoxyprednisolone; 6α-Methyl-9α-fluoro-21-desoxyprednisolone-17-acetate; Eflone; Flarex; Fluorometholone acetate; NSC 47438; Oxylone acetate; U 17323
Hazard Statement
Causes serious eye irritation
Purity
>95% (HPLC)
Smiles
C[C@H]1C[C@H]2[C@@H]3CC[C@](OC(=O)C)(C(=O)C)[C@@]3(C)C[C@H](O)[C@]2(F)[C@@]4(C)C=CC(=O)C=C14
Molecular Formula
C24 H31 F O5
Molecular Weight
418.5
InChI
InChI=1S/C24H31FO5/c1-13-10-19-17-7-9-23(14(2)26,30-15(3)27)22(17,5)12-20(29)24(19,25)21(4)8-6-16(28)11-18(13)21/h6,8,11,13,17,19-20,29H,7,9-10,12H2,1-5H3/t13-,17-,19-,20-,21-,22-,23-,24-/m0/s1
Additionnal Information
IUPAC name: [(6S,8S,9R,10S,11S,13S,14S,17R)-17-acetyl-9-fluoro-11-hydroxy-6,10,13-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl] acetate
Shipping Conditions
Room Temperature
Storage Conditions
-20°C

Chemical Information

Fluorometholone Acetate

Fluorometholone acetate is a steroid ester resulting from the formal condensation of the 17-hydroxy function of fluorometholone with acetic acid. Used in the treatment of steroid responsive inflammatory conditions of the palpebral and bulbar conjunctiva, cornea, and anterior segment of the eye. It has a role as an anti-inflammatory drug. It is a glucocorticoid, an 11beta-hydroxy steroid, a 20-oxo steroid, an acetate ester, a steroid ester, a fluorinated steroid and a 3-oxo-Delta(1),Delta(4)-steroid. It is functionally related to a fluorometholone and a Delta(1)-progesterone.

CAS Number3801-06-7
PubChem CID240767
IUPAC Name[(6S,8S,9R,10S,11S,13S,14S,17R)-17-acetyl-9-fluoro-11-hydroxy-6,10,13-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl] acetate
Molecular FormulaC24H31FO5
Molecular Weight418.5
XLogP2.6
Topological Polar Surface Area80.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count3
Heavy Atom Count30
Formal Charge0
Complexity892
SMILES
C[C@H]1C[C@H]2[C@@H]3CC[C@@]([C@]3(C[C@@H]([C@@]2([C@@]4(C1=CC(=O)C=C4)C)F)O)C)(C(=O)C)OC(=O)C
InChI
InChI=1S/C24H31FO5/c1-13-10-19-17-7-9-23(14(2)26,30-15(3)27)22(17,5)12-20(29)24(19,25)21(4)8-6-16(28)11-18(13)21/h6,8,11,13,17,19-20,29H,7,9-10,12H2,1-5H3/t13-,17-,19-,20-,21-,22-,23-,24-/m0/s1
InChIKey
YRFXGQHBPBMFHW-SBTZIJSASA-N
Chemical Structure
2D Structure
2D structure of Fluorometholone Acetate
CAS: 3801-06-7
CID: 240767
Formula: C24H31FO5
MW: 418.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight418.5
XLogP32.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count3
Exact Mass418.21555225
Monoisotopic Mass418.21555225
Topological Polar Surface Area80.7 Ų
Heavy Atom Count30
Formal Charge0
Complexity892
Isotope Atom Count0
Defined Atom Stereocenter Count8
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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FF23441-01Fluorometholone acetate
HY-B1471RFluorometholone acetate (Standard)
276366-01Δ-9 (11) -Fluorometholone acetate
FE22754-01(9b,11b) -Epoxy fluorometholone acetate
sc-497494(9β,11β) -Epoxy Fluorometholone Acetate
AR-F01738-01Delta-9 (11) -Fluorometholone Acetate
sc-498204Fluorometholone Acetate 6,9 (11) -diene Impurity
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