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triamcinolone hexacetonide

Structure via PubChem · Public domain (PubChem)

EntityQ1593246· pop 8· linked from 9 articles

triamcinolone hexacetonide

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chemical compound

Chemical data

Formula
C30H41FO7
Molecular weight
532.6 g/mol
IUPAC name
[2-[(1S,2S,4R,8S,9S,11S,12R,13S)-12-fluoro-11-hydroxy-6,6,9,13-tetramethyl-16-oxo-5,7-dioxapentacyclo[10.8.0.02,9.04,8.013,18]icosa-14,17-dien-8-yl]-2-oxoethyl] 3,3-dimethylbutanoate
SMILES
C[C@]12C[C@@H]([C@]3([C@H]([C@@H]1C[C@@H]4[C@]2(OC(O4)(C)C)C(=O)COC(=O)CC(C)(C)C)CCC5=CC(=O)C=C[C@@]53C)F)O
InChIKey
TZIZWYVVGLXXFV-FLRHRWPCSA-N
XLogP
4.8
Polar surface area
99.1 Ų
H-bond donors
1
H-bond acceptors
8
Formal charge
0

via PubChem

Drug data · ChEMBL

Max clinical phase
Approved
Molecule type
Small molecule
First approval
1969
Admin. routes
parenteral
Indications
pain, rheumatoid arthritis, joint disease, osteoarthritis

via ChEMBL · EBI

Wikidata facts

Mass
532.284
Show 4 more facts
chemical formula
C₃₀H₄₁FO₇
canonical SMILES
CC1(OC2CC3C4CCC5=CC(=O)C=CC5(C4(C(CC3(C2(O1)C(=O)COC(=O)CC(C)(C)C)C)O)F)C)C
isomeric SMILES
C[C@]12C[C@@H]([C@]3([C@H]([C@@H]1C[C@@H]4[C@]2(OC(O4)(C)C)C(=O)COC(=O)CC(C)(C)C)CCC5=CC(=O)C=C[C@@]53C)F)O
subject has role
anti-inflammatory agent
Sources (2)

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