Conditions | Yield |
---|---|
With mercaptoacetic acid In N,N-dimethyl-formamide for 0.25h; Ambient temperature; | 99.7% |
Conditions | Yield |
---|---|
With Jones reagent In butanone at 0 - 9℃; for 2h; Solvent; | 98.2% |
2-((8S,9S,10R,13S,14S,17R)-17-hydroxy-10,13-dimethyl-3,11-dioxo-2,3,6,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)-2-oxoethyl methanesulfonate
17-hydroxy-pregn-4-ene-3,11,20-trione
Conditions | Yield |
---|---|
With sodium iodide; zinc In 1,2-dimethoxyethane; water for 5h; Heating; | 89% |
17,21-dihydroxy-pregn-4-ene-3,11,20-trione
17-hydroxy-pregn-4-ene-3,11,20-trione
Conditions | Yield |
---|---|
With pyridine; p-toluenesulfonyl chloride Erwaermen des Reaktionsprodukts mit NaI und Essigsaeure; | |
With pyridine; methanesulfonyl chloride Erwaermen des Reaktionsprodukts mit NaI und Essigsaeure; |
Conditions | Yield |
---|---|
With chromium(VI) oxide; acetic acid | |
With pyridine; 4-acetylamino-2,2,6,6-tetramethyl-1-piperidinoxy; O-phenyl phosphorodichloridate In dimethyl sulfoxide; 1,2-dichloro-ethane at 0℃; for 3.5h; | 9.7 g |
With N-chloro-succinimide In chloroform; dimethyl sulfoxide at -30℃; Temperature; Reagent/catalyst; | 9.07 g |
3β,11α,17-trihydroxy-pregn-5-en-20-one
17-hydroxy-pregn-4-ene-3,11,20-trione
Conditions | Yield |
---|---|
With chromium(VI) oxide; sulfuric acid; acetone Isomerisierung des Reaktionsprodukts mit HCl und Essigsaeure; |
4β-chloro-17-hydroxy-5β-pregnane-3,11,20-trione
17-hydroxy-pregn-4-ene-3,11,20-trione
Conditions | Yield |
---|---|
With semicarbazide hydrochloride; sodium acetate Behandeln anschliessend mit Brenztraubensaeure; |
4β-bromo-17-hydroxy-5β-pregnane-3,11,20-trione
17-hydroxy-pregn-4-ene-3,11,20-trione
Conditions | Yield |
---|---|
With pyridine |
17-hydroxy-5β-pregnane-3,11,20-trione
17-hydroxy-pregn-4-ene-3,11,20-trione
Conditions | Yield |
---|---|
With bromine Erhitzen des Reaktionsprodukts mit Pyridin; | |
Multi-step reaction with 2 steps 1: acetic acid; bromine 2: pyridine View Scheme |
17-hydroxy-pregn-4-ene-3,11,20-trione
Conditions | Yield |
---|---|
With ethanol; nickel |
Conditions | Yield |
---|---|
Multi-step reaction with 2 steps 1: mit Hilfe von Rhizopus nigricans 2: CrO3; acetic acid View Scheme |
Conditions | Yield |
---|---|
Multi-step reaction with 2 steps 1: CrO3; water containing acetic acid 2: bromine / Erhitzen des Reaktionsprodukts mit Pyridin View Scheme | |
Multi-step reaction with 3 steps 1: tert-butyl alcohol; N-bromo-acetamide 2: acetic acid; bromine 3: pyridine View Scheme | |
Multi-step reaction with 2 steps 1: tert-butyl hypochlorite; water; tert-butyl alcohol; HCl 2: aqueous semicarbazide hydrochloride; sodium acetate / Behandeln anschliessend mit Brenztraubensaeure View Scheme |
(17Ξ)-3α,11,20-triacetoxy-5β-pregna-9(11),17(20)-diene
17-hydroxy-pregn-4-ene-3,11,20-trione
Conditions | Yield |
---|---|
Multi-step reaction with 4 steps 1: peroxybenzoic acid; benzene / Behandeln des Reaktionsprodukts mit wss.-aethanol.NaOH 2: tert-butyl alcohol; N-bromo-acetamide 3: acetic acid; bromine 4: pyridine View Scheme |
Conditions | Yield |
---|---|
Multi-step reaction with 3 steps 2: CrO3; pyridine 3: aqueous semicarbazide hydrochloride; sodium acetate / Behandeln anschliessend mit Brenztraubensaeure View Scheme |
17-hydroxy-pregn-4-ene-3,11,20-trione
Conditions | Yield |
---|---|
Multi-step reaction with 2 steps 1: CrO3; pyridine 2: aqueous semicarbazide hydrochloride; sodium acetate / Behandeln anschliessend mit Brenztraubensaeure View Scheme |
20,20-ethanediyldioxy-3α,17-dihydroxy-5β-pregnan-11-one
17-hydroxy-pregn-4-ene-3,11,20-trione
Conditions | Yield |
---|---|
Multi-step reaction with 4 steps 1: LiAlH4 / folgenden mit wss.HCl 3: CrO3; pyridine 4: aqueous semicarbazide hydrochloride; sodium acetate / Behandeln anschliessend mit Brenztraubensaeure View Scheme |
3β,11α-diacetoxy-17-hydroxy-pregn-5-en-20-one
17-hydroxy-pregn-4-ene-3,11,20-trione
Conditions | Yield |
---|---|
Multi-step reaction with 2 steps 1: methanol.KOH 2: CrO3; H2SO4; acetone / Isomerisierung des Reaktionsprodukts mit HCl und Essigsaeure View Scheme |
3β,11α-diacetoxy-16β-bromo-17-hydroxy-pregn-5-en-20-one
17-hydroxy-pregn-4-ene-3,11,20-trione
Conditions | Yield |
---|---|
Multi-step reaction with 3 steps 1: palladium/charcoal / Hydrogenation 2: methanol.KOH 3: CrO3; H2SO4; acetone / Isomerisierung des Reaktionsprodukts mit HCl und Essigsaeure View Scheme |
21-chloro-17-hydroxy-pregna-4,9(11)-diene-3,20-dione
17-hydroxy-pregn-4-ene-3,11,20-trione
Conditions | Yield |
---|---|
Multi-step reaction with 3 steps 1: tetrafluoroboric acid; 1,3-dibromo-5,5-dimethylimidazolidine-2,4-dione / butanone; water / 3.5 h / 0 - 5 °C / Inert atmosphere 2: Jones reagent / tetrahydrofuran / 2 h / 0 - 5 °C 3: acetic acid; zinc / tetrahydrofuran / 11 h / 20 - 55 °C / Inert atmosphere View Scheme | |
Multi-step reaction with 4 steps 1: zinc; acetic acid / butanone / 50 - 55 °C 2: water; 1,3-dibromo-5,5-dimethylimidazolidine-2,4-dione; tetrafluoroboric acid / acetone / 3 h / 0 - 5 °C / Inert atmosphere 3: chromium chloride; mercaptoacetic acid; zinc / dimethyl sulfoxide / 2 h / 0 - 5 °C / Inert atmosphere 4: Jones reagent / butanone / 2 h / 0 - 9 °C View Scheme |
17-hydroxy-pregn-4-ene-3,11,20-trione
Conditions | Yield |
---|---|
With acetic acid; zinc In tetrahydrofuran at 20 - 55℃; for 11h; Solvent; Temperature; Reagent/catalyst; Inert atmosphere; | 80.6 g |
pregna-4,9(11)-diene-3,20-dione-17-hydroxy-21-methyl
17-hydroxy-pregn-4-ene-3,11,20-trione
Conditions | Yield |
---|---|
Multi-step reaction with 3 steps 1: water; 1,3-dibromo-5,5-dimethylimidazolidine-2,4-dione; tetrafluoroboric acid / acetone / 3 h / 0 - 5 °C / Inert atmosphere 2: chromium chloride; mercaptoacetic acid; zinc / dimethyl sulfoxide / 2 h / 0 - 5 °C / Inert atmosphere 3: Jones reagent / butanone / 2 h / 0 - 9 °C View Scheme |
17-hydroxy-pregn-4-ene-3,11,20-trione
trimethyl orthoformate
17α-hydroxy-3-methoxypregna-3,5-diene-11,20-dione
Conditions | Yield |
---|---|
With toluene-4-sulfonic acid In 1,4-dioxane for 1.25h; Ambient temperature; | 76.5% |
17-hydroxy-pregn-4-ene-3,11,20-trione
21-hydroxy-1,4-pregnadiene-3,11,20-trione
Conditions | Yield |
---|---|
mit Hilfe von Corynebacterium simplex; |
Conditions | Yield |
---|---|
With Pd-BaSO4; ethyl acetate Hydrogenation; |
17-hydroxy-pregn-4-ene-3,11,20-trione
ethylene glycol
3,3;20,20-bis-ethanediyldioxy-17-hydroxy-pregn-5-en-11-one
Conditions | Yield |
---|---|
With toluene-4-sulfonic acid; benzene | |
With trimethyloxosulfonium bromide; orthoformic acid triethyl ester for 5h; |
17-hydroxy-pregn-4-ene-3,11,20-trione
(8S,9S,10R,13S,14S,17R)-17-Hydroxy-17-(1-hydroxy-ethyl)-10,13-dimethyl-1,6,7,8,9,10,12,13,14,15,16,17-dodecahydro-2H-cyclopenta[a]phenanthrene-3,11-dione
Conditions | Yield |
---|---|
With 20β-hydroxysteroid dehydrogenase at 25℃; Rate constant; pH 6.4; |
17-hydroxy-pregn-4-ene-3,11,20-trione
6β,17α-dihydroxy-5β-pregnane-3,11,20-trione
Conditions | Yield |
---|---|
Multi-step reaction with 3 steps 1: 76.5 percent / toluene-p-sulphonic acid / dioxane / 1.25 h / Ambient temperature 2: 45.6 percent / O2 / ethanol / 5 h / Irradiation 3: 54 percent / H2 / Pd-CaCO3 / pyridine View Scheme |
17-hydroxy-pregn-4-ene-3,11,20-trione
6β,17α-dihydroxy-pregn-4-ene-3,11,20-trione
Conditions | Yield |
---|---|
Multi-step reaction with 2 steps 1: 76.5 percent / toluene-p-sulphonic acid / dioxane / 1.25 h / Ambient temperature 2: 45.6 percent / O2 / ethanol / 5 h / Irradiation View Scheme |
17-hydroxy-pregn-4-ene-3,11,20-trione
3α,6β,17,20α-tetrahydroxy-5β-pregnan-11-one 6-hemisuccinate
Conditions | Yield |
---|---|
Multi-step reaction with 5 steps 1: 76.5 percent / toluene-p-sulphonic acid / dioxane / 1.25 h / Ambient temperature 2: 45.6 percent / O2 / ethanol / 5 h / Irradiation 3: 54 percent / H2 / Pd-CaCO3 / pyridine 4: 34.3 percent / pyridine / 5 h / Heating 5: 23 percent / cerous chloride, sodium borohydrode / methanol / 5 h / Ambient temperature View Scheme |
17-hydroxy-pregn-4-ene-3,11,20-trione
6β,17α-dihydroxy-5β-pregnane-3,11,20-trione 6-hemisuccinate
Conditions | Yield |
---|---|
Multi-step reaction with 4 steps 1: 76.5 percent / toluene-p-sulphonic acid / dioxane / 1.25 h / Ambient temperature 2: 45.6 percent / O2 / ethanol / 5 h / Irradiation 3: 54 percent / H2 / Pd-CaCO3 / pyridine 4: 34.3 percent / pyridine / 5 h / Heating View Scheme |
17-hydroxy-pregn-4-ene-3,11,20-trione
pregnane-4,9(11),16(17)-triene-3,20-dione
Conditions | Yield |
---|---|
Multi-step reaction with 4 steps 1: benzene; toluene-4-sulfonic acid 2: sodium borate; ethanol 3: thionyl chloride; pyridine 4: aqueous acetic acid View Scheme |
17-hydroxy-pregn-4-ene-3,11,20-trione
16α,17α-dihydroxy-17β-methyl-D-homo-androsta-4,9(11)-diene-3,17a-dione
Conditions | Yield |
---|---|
Multi-step reaction with 6 steps 1: benzene; toluene-4-sulfonic acid 2: sodium borate; ethanol 3: thionyl chloride; pyridine 4: aqueous acetic acid 5: OsO4 6: Al2O3 View Scheme |
17-hydroxy-pregn-4-ene-3,11,20-trione
16α,17-dihydroxy-pregna-4,9(11)-diene-3,20-dione
Conditions | Yield |
---|---|
Multi-step reaction with 5 steps 1: benzene; toluene-4-sulfonic acid 2: sodium borate; ethanol 3: thionyl chloride; pyridine 4: aqueous acetic acid 5: OsO4 View Scheme |
17-hydroxy-pregn-4-ene-3,11,20-trione
11-oxomedroxyprogesterone
Conditions | Yield |
---|---|
Multi-step reaction with 5 steps 1: benzene; toluene-4-sulfonic acid 2: chloroform; diethyl ether 3: benzene 4: aqueous methanol.H2SO4 5: methanol.KOH View Scheme | |
Multi-step reaction with 3 steps 1: toluene-4-sulfonic acid / dichloromethane; water 2: N-methylaniline; hydrogenchloride / tetrahydrofuran 3: hydrogenchloride; palladium on activated charcoal / ethanol; cyclohexene View Scheme |
17-hydroxy-pregn-4-ene-3,11,20-trione
5,17-dihydroxy-6β-methyl-5α-pregnane-3,11,20-trione
Conditions | Yield |
---|---|
Multi-step reaction with 4 steps 1: benzene; toluene-4-sulfonic acid 2: chloroform; diethyl ether 3: benzene 4: aqueous methanol.H2SO4 View Scheme |
17-hydroxy-pregn-4-ene-3,11,20-trione
21-acetoxy-17-hydroxy-6α-methyl-pregn-4-ene-3,11,20-trione
Conditions | Yield |
---|---|
Multi-step reaction with 6 steps 1: benzene; toluene-4-sulfonic acid 2: chloroform; diethyl ether 3: benzene 4: aqueous methanol.H2SO4 5: methanol.KOH 6: iodine; CaO; methanol / Reagens 4: THF; beim anschliessenden Erwaermen mit Kaliumacetat in Aceton View Scheme |
The 21-Deoxycortisone, with the CAS registry number 1882-82-2, is also known as 4-Pregnene-17α-ol-3,11,20-trione. It belongs to the product categories of Steroids; Steroids & Hormones - 13C & 2H; Intermediates & Fine Chemicals; Metabolites & Impurities; Pharmaceuticals. Its EINECS number is 217-541-5. This chemical's molecular formula is C21H28O4 and molecular weight is 344.44. What's more, its systematic name is 17-Hydroxypregn-4-ene-3,11,20-trione. This chemical is used as a cortisone derivative and a glucocorticoid.
Physical properties of 21-Deoxycortisone are: (1)ACD/LogP: 1.738; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.74; (4)ACD/LogD (pH 7.4): 1.74; (5)ACD/BCF (pH 5.5): 12.33; (6)ACD/BCF (pH 7.4): 12.33; (7)ACD/KOC (pH 5.5): 210.16; (8)ACD/KOC (pH 7.4): 210.16; (9)#H bond acceptors: 4; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 71.44 Å2; (13)Index of Refraction: 1.568; (14)Molar Refractivity: 92.637 cm3; (15)Molar Volume: 282.984 cm3; (16)Polarizability: 36.724×10-24cm3; (17)Surface Tension: 50.0 dyne/cm; (18)Density: 1.217 g/cm3; (19)Flash Point: 285.129 °C; (20)Enthalpy of Vaporization: 91.873 kJ/mol; (21)Boiling Point: 524.571 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C(C)[C@@]3(O)CC[C@H]2[C@@H]4CC\C1=C\C(=O)CC[C@]1(C)[C@H]4C(=O)C[C@@]23C
(2)Std. InChI: InChI=1S/C21H28O4/c1-12(22)21(25)9-7-16-15-5-4-13-10-14(23)6-8-19(13,2)18(15)17(24)11-20(16,21)3/h10,15-16,18,25H,4-9,11H2,1-3H3/t15-,16-,18+,19-,20-,21-/m0/s1
(3)Std. InChIKey: PUKLDDOGISCFCP-JSQCKWNTSA-N
About|Contact|Cas|Product Name|Molecular|Country|Encyclopedia
Message|New Cas|MSDS|Service|Advertisement|CAS DataBase|Article Data|Manufacturers | Chemical Catalog
©2008 LookChem.com,License: ICP
NO.:Zhejiang16009103
complaints:service@lookchem.com Desktop View