Chemistry:Dexamethasone isonicotinate

Short description: Chemical compound

Dexamethasone isonicotinate

Skeletal formula of dexamethasone isonicotinate
Ball-and-stick model of the dexamethasone isonicotinate molecule
Clinical data
Trade names	Auxiloson, Auxilson, Auxilsone, Voren
Other names	Dexamethasone 21-isonicotinate; Dexamethasone 21-(4-Pyridinecarboxylate); HE-111; 9α-Fluoro-11β,17α-dihydroxy-16α-methyl-3,20-dioxopregna-1,4-dien-21-yl isonicotinate; 9α-Fluoro-11β,17α,21-trihydroxy-16α-methylpregna-1,4-diene-3,20-dione 21-(4-pyridinecarboxylate)
Identifiers
IUPAC name 2-[(1R,2R,3aS,3bS,9aS,9bR,10S,11aS)-9b-fluoro-1,10-dihydroxy-2,9a,11a-trimethyl-7-oxo-2,3,3a,3b,4,5,7,9a,9b,10,11,11a-dodecahydro-1H-cyclopenta[a]phenanthren-1-yl]-2-oxoethyl pyridine-4-carboxylate
CAS Number	2265-64-7
PubChem CID	16752
DrugBank	DB11487
ChemSpider	15881
UNII	8LGC0BOA71
KEGG	D07797
ChEBI	CHEBI:177639
ChEMBL	ChEMBL3186453
Chemical and physical data
Formula	C28H32FNO6
Molar mass	497.563 g·mol−1
3D model (JSmol)	Interactive image
SMILES C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@@]4([C@]3([C@H](C[C@@]2([C@]1(C(=O)COC(=O)C5=CC=NC=C5)O)C)O)F)C
InChI InChI=1S/C28H32FNO6/c1-16-12-21-20-5-4-18-13-19(31)6-9-25(18,2)27(20,29)22(32)14-26(21,3)28(16,35)23(33)15-36-24(34)17-7-10-30-11-8-17/h6-11,13,16,20-22,32,35H,4-5,12,14-15H2,1-3H3/t16-,20+,21+,22+,25+,26+,27+,28+/m1/s1 Key:BQTXJHAJMDGOFI-NJLPOHDGSA-N

Dexamethasone isonicotinate is an anti-inflammatory, anti-allergic glucocorticoid that can be administered orally, by inhalation, locally, and parenterally. It may cause salt and water retention.