Sodium taurocholate
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Sodium taurocholate
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CAS No:
145-42-6
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Formula:
C26H45NO7S.Na
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Chemical Name:
Sodium taurocholate
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Synonyms:
Ethanesulfonic acid,2-[[(3α,5β,7α,12α)-3,7,12-trihydroxy-24-oxocholan-24-yl]amino]-,sodium salt (1:1);Taurine,N-choloyl-,monosodium salt;Ethanesulfonic acid,2-[[(3α,5β,7α,12α)-3,7,12-trihydroxy-24-oxocholan-24-yl]amino]-,monosodium salt;Taurocholic acid monosodium salt;Sodium taurocholate;Taurocholic acid sodium salt;Taurocholate sodium;Monosodium taurocholate;130860-43-4;8002-22-0;69258-29-3
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CAS No:
Description
White to off-white powder
The product of conjugation of cholic acid with taurine. Its sodium salt is the chief ingredient of the bile of carnivorous animals. It acts as a detergent to solubilize fats for absorption and is itself absorbed. It is used as a cholagogue and cholerectic.
Characteristics
155
3.49720
White powder.
1.177 g/cm3 @ Temp: 22.5 °C
225-235 °C
9℃
23 ° (C=3, H2O)
H2O: 0.5 M at 20 °C, clear, colorless to faintly yellow
0-6°C
23 º (c=3 H2O)
Safety Information
UN1230 - class 3 - PG 2 - Methanol, solution
3
36/37/38
26-36/37/39-24/25
WX0400000
Stable under normal temperatures and pressures.
Drug Information
Gastrointestinal agents that stimulate the flow of bile into the duodenum (cholagogues) or stimulate the production of bile by the liver (choleretic). (See all compounds classified as Cholagogues and Choleretics.)|Purifying or cleansing agents, usually salts of long-chain aliphatic bases or acids, that exert cleansing (oil-dissolving) and antimicrobial effects through a surface action that depends on possessing both hydrophilic and hydrophobic properties. (See all compounds classified as Detergents.)
Cholyltaurine
Sodium taurocholate Use and Manufacturing
selectively activates retinoid X receptors (RXRs)
Ethanesulfonic acid, 2-[[(3.alpha.,5.beta.,7.alpha.,12.alpha.)-3,7,12-trihydroxy-24-oxocholan-24-yl]amino]-, sodium salt (1:1): ACTIVE
Computed Properties
Molecular Weight:537.7
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:7
Exact Mass:537.27361820
Monoisotopic Mass:537.27361820
Topological Polar Surface Area:155
Heavy Atom Count:36
Complexity:897
Undefined Atom Stereocenter Count:11
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
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