Grundinformationen
- CAS
67-78-7- Standard-SMILES
CC(=O)OCC(=O)[C@@]1(O)[C@H](OC(C)=O)C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@@]21C- InChIKey
XGMPVBXKDAHORN-RBWIMXSLSA-N- Summenformel
- C25H31FO8
- Durchschnittliche Molmasse
- 478,5 g/mol
- Monoisotopische Masse
- 478,2002961
Überblick
Triamcinolone diacetate is a corticosteroid hormone.
Namen und Bezeichner
- Bevorzugter Name
- Triamcinolone Diacetate
- IUPAC
- [2-[(8S,9R,10S,11S,13S,14S,16R,17S)-16-acetyloxy-9-fluoro-11,17-dihydroxy-10,13-dimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] acetate
- Lokaler Name
- Triamcinolon-16-α,21-di(acetat)
- Englischer Name
- Triamcinolone diacetate
- Summenformel
- C25H31FO8
- Molmasse
- 478.51
Namen und Synonyme
TRIAMCINOLONE DIACETATE67-78-7Aristocort ForteTedarolTriamcinolone 16,21-diacetateDTXSID0048713A73MM2Q32PNSC-757356DTXCID3028639Pregna-1,4-diene-3,20-dione, 16,21-bis(acetyloxy)-9-fluoro-11,17-dihydroxy-, (11beta,16alpha)-RefChem:56156Orion
Weitere Namen anzeigen
TAC-D8357RPCINO-40CenacortTracilon21-diacetateTriamolone 40aristocortsyrup
Aristocort diacetateTriamcinolone EP Impurity AKenacourtAristocort ParenteralsC25H31FO8CHEBI:9669Aristocort diacetate forteAristocort Forte Parenteral
Datenbank-Bezeichner
- CAS
67-78-7- PubChem CID
- 6216
- DTXSID
DTXSID0048713
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 1,9
- Polarare Oberfläche (TPSA)
- 127 Ų
- H-Brücken-Donoren
- 2
- H-Brücken-Akzeptoren
- 9
- Frei drehbare Bindungen
- 6
- Schwere Atome
- 34
- Formalladung
- 0
- Komplexität
- 1.020
Experimentelle und physikochemische Eigenschaften
LogP1.92
Human Drugs
FDA approved drugs -> Active ingredient
FDA approved drugs -> Active ingredient
Pharmaceuticals
Collision Cross Section209.5 Ų [M+H]+ [CCS Type: TW; Method: calibrated with polyalanine and drug standards]
Physikochemische Eigenschaften
- Schmelzpunkt
- 186 · 186-188 C
- Siedepunkt
- 608.5 · 608.5±55.0 °C(Predicted)
- Dichte
- 1.2087 · 1.2087 (estimate)
- storage temp.
- Refrigerator
- Löslichkeit
- Chloroform (Slightly, Heated), DMSO (Slightly), Methanol (Slightly)
- pka
- 11.21 · 11.21±0.70(Predicted)
- Aggregatzustand
- Solid
- Farbe
- White
- Wasserlöslichkeit
- 48 mg/L · 48mg/L(25 ºC)
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
Danger
H301 (25%): Toxic if swallowed [Danger Acute toxicity, oral]
P203, P261, P264, P270, P271, P280, P301+P316, P301+P317, P302+P352, P304+P340, P317, P318, P321, P330, P362+P364, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 4 reports by companies from 3 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, 16,21-bis(acetyloxy)-9-fluoro-11,17-dihydroxy-, (11.beta.,16.alpha.)-: Environment tier I assessment
Hazard Classes and CategoriesAcute Tox. 4 (25%)
Sicherheitsdaten
- wgk
- 3
- hs_code
- 2937220000
Chemie und Industrie
Pharmakologische Informationen
MeSH Pharmacological ClassificationCompounds or agents that combine with an enzyme in such a manner as to prevent the normal substrate-enzyme combination and the catalytic reaction.
Verwendung und Herstellung
Use ClassificationPharmaceuticals
Anwendungen
VerwendenA glucocorticoid that inhibits prolyl hydroxylase activity, Triamcinolone diacetate can be used as an antiasthmatic and antiallergic drug.
Vor- und nachgelagerte Produkte
Vorgelagerte Rohstoffe
Anbieter72 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]
江苏智芯廷科技有限公司18221391031 · [email protected]
清宁生物（江苏博泉生物科技有限公司）19352250998 · [email protected]
江苏艾康生物医药研发有限公司025-66061636 19370895928 · [email protected]
Hebei shuoxi biotechnology co. LTD+8613081092107
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