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Chemical structure of Triamcinolone hexacetonide

GC33897

Triamcinolone hexacetonide

Also known as [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

Triamcinolone hexacetonide is a commonly used long-acting steroids in treatment of subacute and chronic inflammatory joint diseases

ChemicalCAS5611-51-8MW532.64FormulaC30H41FO7
CAS number
5611-51-8
Molecular weight
532.64
Formula
C30H41FO7
Solubility
DMSO ： 41·67 mg/mL (78·23 mM);Water ： ＜ 0·1 mg/mL (insoluble)
InChIKey
TZIZWYVVGLXXFV-FLRHRWPCSA-N
Catalogue number
GC33897
Brand
GLPBIO
Computed properties PubChem CID 21826 · XLogP 4.8 · TPSA 99.1 Ų · H-bond donors 1
XLogP
4.8
TPSA
99.1 Ų
H-bond donors
1
H-bond acceptors
8
Rotatable bonds
6
Heavy atoms
38

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

Computed descriptors from PubChem (CID 21826), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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