Grundinformationen
- CAS
5611-51-8- Standard-SMILES
CC(C)(C)CC(=O)OCC(=O)[C@@]12OC(C)(C)O[C@@H]1C[C@H]1[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@@]12C- InChIKey
TZIZWYVVGLXXFV-FLRHRWPCSA-N- Summenformel
- C30H41FO7
- Durchschnittliche Molmasse
- 532,6 g/mol
- Monoisotopische Masse
- 532,2836318
Überblick
Triamcinolone hexacetonide is a corticosteroid hormone.
Namen und Bezeichner
- Bevorzugter Name
- Triamcinolone Hexacetonide
- IUPAC
- [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
- Lokaler Name
- Triamcinolonhexacetonid
- Englischer Name
- Triamcinolone hexacetonide
- Summenformel
- C30H41FO7
- Molmasse
- 532.64
Namen und Synonyme
TRIAMCINOLONE HEXACETONIDE5611-51-8AristospanTATBALederspanDTXSID0048634CL 34433I7GT1U99Y9HexatrioneDTXCID7028560Pregna-1,4-diene-3,20-dione, 21-(3,3-dimethyl-1-oxobutoxy)-9-fluoro-11-hydroxy-16,17-((1-methylethylidene)bis(oxy))-, (11beta,16alpha)-(11beta,16alpha)-21-(3,3-Dimethyl-1-oxobutoxy)-9-fluoro-11-hydroxy-16,17-((1-methylethylidene)bis(oxy))pregna-1,4-diene-3,20-dione
Weitere Namen anzeigen
Triamcinide caproateC08185cl34433HextrianideTriamcinolone hexatonideTRIAMCINOLONEHEXACETONIDE,USP
(11beta,16alpha)-21-(3,3-Dimethyl-1-oxobutoxy)-9-fluoro-11-hydroxy-16,17-[(1-methylethylidene)bis(oxy)]pregna-1,4-diene-3,20-dioneHexatrione 2%Pregna-1,4-diene-3,20-dione,21-(3,3-dimethyl-1-oxobutoxy)-9-fluoro-11-hydroxy-16,17-((1-methylethylidene)bis(oxy))-,(11b,16a)-Pregna-1,4-diene-3,20-dione,21-(3,3-dimethyl-1-oxobutoxy)-9-fluoro-11-hydroxy-16,17-[(1-methylethylidene)bis(oxy)]-,(11b,16a)-RefChem:561579-fluoro-11 beta,16 alpha,17,21-tetrahydroxypregna-1,4-diene-3,20-dione cyclic 16,17-acetal with acetone, 21-(3,3-dimethylbutyrate)(11 beta, 16 alpha)-21-(3,3-dimethyl-1-oxobutoxy)-9-fluoro-11-hydroxy-16,17-((1-methylethylidene)bis(oxy)) pregna-1,4-diene-3,20-dione227-031-4
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 4,8
- Polarare Oberfläche (TPSA)
- 99,1 Ų
- H-Brücken-Donoren
- 1
- H-Brücken-Akzeptoren
- 8
- Frei drehbare Bindungen
- 6
- Schwere Atome
- 38
- Formalladung
- 0
- Komplexität
- 1.130
Experimentelle und physikochemische Eigenschaften
Human Drugs
FDA approved drugs -> Active ingredient
FDA approved drugs -> Active ingredient
Pharmaceuticals
Medicines for juvenile joint diseases
Physikochemische Eigenschaften
- Schmelzpunkt
- 295 · 295-296° (dec); mp 271-272° (dec)
- Siedepunkt
- 619.5 · 619.5±55.0 °C(Predicted)
- Dichte
- 1.1277 · 1.1277 (estimate)
- storage temp.
- 2 · 2-8°C
- Löslichkeit
- Practically insoluble in water, sparingly soluble in anhydrous ethanol and in methanol.
- pka
- 13.09 · 13.09±0.70(Predicted)
- Aggregatzustand
- Solid
- Farbe
- Fine, white, needle-like crystals
- Major Application
- pharmaceuticalpharmaceutical small molecule
- InChIKey
- TZIZWYVVGLXXFV-FLRHRWPCSA-N
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
Danger
H302 (60%): Harmful if swallowed [Warning Acute toxicity, oral]
P203, P233, P260, P261, P264, P270, P271, P272, P280, P284, P301+P317, P302+P352, P304+P340, P317, P318, P319, P321, P330, P333+P317, P342+P316, P362+P364, P403, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 5 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Gefahrenhinweise
Other Safety InformationIMAP assessments - Pregna-1,4-diene-3,20-dione, 21-(3,3-dimethyl-1-oxobutoxy)-9-fluoro-11-hydroxy-16,17-[(1-methylethylidene)bis(oxy)]-, (11.beta.,16.alpha.)-: Human health tier I assessment
Hazard Classes and CategoriesAcute Tox. 4 (60%)
Sicherheitsdaten
- wgk
- 3
- hs_code
- 2937220000
- Speicherklasse
- 11 - Combustible Solids
- Hazard Classifications
- Repr. 2
Chemie und Industrie
Pharmakologische Informationen
ATC CodeH02AB08
FDA Pharmacological Classification
TRIAMCINOLONE HEXACETONIDE
Corticosteroid Hormone Receptor Agonists [MoA]; Corticosteroid [EPC]
MeSH Pharmacological ClassificationSubstances that reduce or suppress INFLAMMATION.
Verwendung und Herstellung
Use ClassificationPharmaceuticals
Anwendungen
VerwendenTriamcinolone Hexacetonide is the Intra-articular glucocorticoid treatment for rheumatoid arthritis.
Anbieter47 Anbieter
国药集团化学试剂有限公司86-21-63210123 · [email protected]
艾吉析科技（上海）有限公司17717235263 · [email protected]
武汉灵灵九生物科技有限公司15623309010
Suzhou ARTK Medchem Co., Ltd.+86-18168183658 · [email protected]
Aladdin Scientific[email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
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