CAS 337-02-0 9-Fluoro-11beta,16alpha,17,21-tetrahydroxypregn-4-ene-3,20-dione (HCID 228785)

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Grundinformationen

CAS: 337-02-0
Standard-SMILES: C[C@]12CCC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F
InChIKey: SXQQMCLQCSKJNC-OBYCQNJPSA-N
Summenformel: C21H29FO6
Durchschnittliche Molmasse: 396,4 g/mol
Monoisotopische Masse: 396,1948168

Namen und Bezeichner

Bevorzugter Name: 9-Fluoro-11beta,16alpha,17,21-tetrahydroxypregn-4-ene-3,20-dione
IUPAC: (8S,9R,10S,11S,13S,14S,16R,17S)-9-fluoro-11,16,17-trihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-one
Lokaler Name: 9-Fluor-11β,16α,17,21-tetrahydroxypregn-4-en-3,20-dion
Englischer Name: 9-fluoro-11beta,16alpha,17,21-tetrahydroxypregn-4-ene-3,20-dione
Summenformel: C21H29FO6
Molmasse: 396.46

Namen und Synonyme

337-02-09-Fluoro-11beta,16alpha,17,21-tetrahydroxypregn-4-ene-3,20-dionePretriamcinoloneTriamcinolone EP Impurity C1,2-Dihydrotriamcinolone9|A-Fluoro-16|A-hydroxyhydrocortisone549QHA3WRP9alpha-Fluoro-16alpha-hydroxyhydrocortisone9alpha-Fluoro-11beta,16alpha,17alpha,21-tetrahydroxypregn-4-ene-3,20-dioneNSC-21913(8S,9R,10S,11S,13S,14S,16R,17S)-9-fluoro-11,16,17-trihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-one1,2-Dihydro Triamcinolone

Weitere Namen anzeigen

Halcinonide USP Impurity aTriamcinolone EP Impurity C (Pretriamcinolone)9-Fluoro-11β,16α,17,21-tetrahydroxypregn-4-ene-3,20-dione(11β,16α)-Fluoro-11,16,17,21-tetrahydroxypregn-4-ene-3,20-dionePregn-4-ene-3,20-dione, 9-fluoro-11,16,17,21-tetrahydroxy-, (11β,16α)-

Triamcinolone impurity CMLS002638823SKI 244819-Fluoro-11beta,16alpha,17,21-tetrahydroxypregn-4-ene-3,20-dione; Triamcinolone Imp. C (EP); PretriamcinoloneEINECS 206-411-3UNII-549QHA3WRPCorticosterone,17-dihydroxy-Triamcinolone impurity C CRS

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 1
Polarare Oberfläche (TPSA): 115 Å²
H-Brücken-Donoren: 4
H-Brücken-Akzeptoren: 7
Frei drehbare Bindungen: 2
Schwere Atome: 28
Formalladung: 0
Komplexität: 766

Physikochemische Eigenschaften

Schmelzpunkt: 257 · 257-260 °C (decomp)
Siedepunkt: 585.2 · 585.2±50.0 °C(Predicted)
Dichte: 1.39 · 1.39±0.1 g/cm3(Predicted)
storage temp.: Refrigerator
Löslichkeit: DMSO (Slightly), Pyridine (Slightly)
pka: 11.58 · 11.58±0.70(Predicted)
Farbe: White to Off-White
Major Application: pharmaceutical (small molecule)
InChIKey: SXQQMCLQCSKJNC-OBYCQNJPSA-N
SMILES: F[C@@]21[C@H]([C@H]4[C@@]([C@@]([C@@H](C4)O)(O)C(=O)CO)(C[C@@H]2O)C)CCC3=CC(=O)CC[C@@]31C

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H373 (100%): May causes damage to organs through prolonged or repeated exposure [Warning Specific target organ toxicity, repeated exposure]

P260, P264, P270, P301+P317, P319, P330, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Sicherheitsdaten

Alarmwort: Warnung
Gefahrenhinweise: Code Gefahrenhinweise Gefahrenklasse Abteilung Alarmwort Symbol P-Code H302

Chemie und Industrie

Anwendungen

Verwenden1,2-Dihydro Triamcinolone is a derivative of Triamcinolone (T767165), a glucocorticoid, antiasthmatic (inhalant); antiallergic (nasal).

Anbieter28 Anbieter

武汉敬康恩生物医药科技有限公司13720134139 086-15871494362 13720134139 · [email protected]

清宁生物（江苏博泉生物科技有限公司）19352250998 · [email protected]

廊坊市恒福源医药科技有限公司0316-2883537 19333636468 · [email protected]

孟成科技（上海）有限公司400-820-6829 · [email protected]

欧利希（湖北）医药科技有限公司17316404525 17316404525 · [email protected]

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HRID 267904als Eduktuspto-grants-1976_03

HRID 267907als Eduktuspto-grants-1976_03

HRID 918371als Eduktuspto-grants-1976_07

HRID 1488445als Produktuspto-grants-1997_10

HRID 1585479als Produktuspto-grants-1999_08

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