(7R,8S,9S,10R,13R,14S,17R)-7-hydroxy-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one

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(7R,8S,9S,10R,13R,14S,17R)-7-hydroxy-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one Suppliers list
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CAS:3862-25-7
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(7R,8S,9S,10R,13R,14S,17R)-7-hydroxy-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one manufacturers
(7R,8S,9S,10R,13R,14S,17R)-7-hydroxy-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one Basic information
Product Name:(7R,8S,9S,10R,13R,14S,17R)-7-hydroxy-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one
Synonyms:7 alpha-hydroxy-4-cholesten-3-one;(7a)-7-Hydroxycholest-4-en-3-one;7a-Hydroxycholest-4-en-3-one;(7R,8S,9S,10R,13R,14S,17R)-7-hydroxy-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one;(7R,8S,9S,10R,13R,14S,17R)-7-hydroxy-10,13-diMethyl-17-((R)-6-Methylheptan-2-yl)-6,7,8,9,10,11,12,13,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3(2H)-one;7HCO;7Α-HYDROXY-4-CHOLESTEN-3-ONE;7Α-HYDROXYCHOLESTENONE;7HCO;ALPHA-HC;Α-HC;7α-hydroxycholestenone
CAS:3862-25-7
MF:C27H44O2
MW:400.64
EINECS:
Product Categories:Various Metabolites and Impurities;Intermediates & Fine Chemicals;Metabolites & Impurities;Pharmaceuticals;Steroids
Mol File:3862-25-7.mol
(7R,8S,9S,10R,13R,14S,17R)-7-hydroxy-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one Structure
(7R,8S,9S,10R,13R,14S,17R)-7-hydroxy-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one Chemical Properties
Melting point 182-184°C
Boiling point 516.7±29.0 °C(Predicted)
density 1.03±0.1 g/cm3(Predicted)
storage temp. -20°C Freezer
solubility Chloroform (Slightly), Methanol (Slightly)
pka14.49±0.70(Predicted)
form Solid
color White to Off-White
Major Applicationclinical testing
InChIKeyIOIZWEJGGCZDOL-RQDYSCIWSA-N
SMILESO=C1CC[C@@]2(C)C(C[C@@H](O)[C@]3([H])[C@]2([H])CC[C@@]4(C)[C@@]3([H])CC[C@]4([H])[C@H](C)CCCC(C)C)=C1
Safety Information
WGK Germany WGK 3
Storage Class11 - Combustible Solids
MSDS Information
(7R,8S,9S,10R,13R,14S,17R)-7-hydroxy-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one Usage And Synthesis
Description7α-hydroxy-4-Cholesten-3-one is a metabolite of 7α-hydroxy cholesterol and an intermediate in the biosynthesis of bile acids. Plasma levels of 7α-hydroxy-4-cholesten-3-one positively correlate with the rate of bile acid synthesis in humans and are increased in patients following ileal resection.
Chemical PropertiesWhite Solid
Uses7α-Hydroxy-4-cholesten-3-one is a metabolite of Cholesterol (C432501).
DefinitionChEBI: A cholestanoid consisting of a cholesterol core having an oxo group at the 3-position, a C2C bond at the 4,5-position and an alpha-hydroxy group at the 7-position.
References[1] RUSSELL D W. The enzymes, regulation, and genetics of bile acid synthesis.[J]. Annual review of biochemistry, 2003, 72: 137-174. DOI: 10.1146/annurev.biochem.72.121801.161712
[2] M. AXELSON  J. S  A Aly. Levels of 7α-hydroxy-4-cholesten-3-one in plasma reflect rates of bile acid synthesis in man[J]. FEBS Letters, 1988, 239 2: Pages 324-328. DOI: 10.1016/0014-5793(88)80944-x
(7R,8S,9S,10R,13R,14S,17R)-7-hydroxy-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one Preparation Products And Raw materials
Raw materialsCholest-4-en-3-one, 7-(formyloxy)-, (7α)--->Cholest-5-ene-3,7-diol, 3-acetate, (3β,7α)--->5-CHOLESTEN-3-BETA, 7-ALPHA-DIOL-->7-oxocholest-5-en-3-beta-yl acetate
Preparation Products4,6-CHOLESTADIEN-3-ONE
Tag:(7R,8S,9S,10R,13R,14S,17R)-7-hydroxy-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one(3862-25-7) Related Product Information
4-hydrostyrene (7R,8S,9S,10R,13R,14S,17R)-7-hydroxy-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one 4-Cholesten-3-one CHOLEST-4-ENE