Molecular Identity
Triamcinolone Acetonide
(1S,2S,4R,8S,9S,11S,12R,13S)-12-fluoro-11-hydroxy-8-(2-hydroxyacetyl)-6,6,9,13-tetramethyl-5,7-dioxapentacyclo[10.8.0.02,9.04,8.013,18]icosa-14,17-dien-16-one
PubChem CID: 6436
Triamcinolone acetonide is a synthetic glucocorticoid that is the 16,17-acetonide of triamcinolone. Used to treat various skin infections. It has a role as an anti-inflammatory drug and an anti-allergic agent. It is a primary alpha-hydroxy ketone, a glucocorticoid, a 21-hydroxy steroid, an 11beta-hydroxy steroid, a 20-oxo steroid, a 3-oxo-Delta(4) steroid, a fluorinated steroid and a cyclic ketal. It is functionally related to a triamcinolone. It derives from a hydride of a pregnane.
2D Structure
Properties
C24H31FO6
Molecular Formula
434.50
Molecular Weight
g/mol
434.2105
Exact Mass
Da
2.5
XLogP
Drug-like (Lipinski: < 5)
93.1
TPSA
Good oral absorption (< 140 A²)
2
H-Bond Donors
7
H-Bond Acceptors
925
Complexity
SMILES
Canonical SMILES
SMILES: CC1(OC2CC3C4CCC5=CC(=O)C=CC5(C4(C(CC3(C2(O1)C(=O)CO)C)O)F)C)CIsomeric SMILES
SMILES: C[C@]12C[C@@H]([C@]3([C@H]([C@@H]1C[C@@H]4[C@]2(OC(O4)(C)C)C(=O)CO)CCC5=CC(=O)C=C[C@@]53C)F)OSynonyms(20)
TRIAMCINOLONE ACETONIDE76-25-5AzmacortNasacortVetalogSolodelfTricinolonKenacort-AVolon AAristogelTramacinZilrettaOraloneRinetonTriacet
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to Triamcinolone Acetonide
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