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Name |
Taurolithocholic acid |
EINECS | N/A |
CAS No. | 516-90-5 | Density | 1.169g/cm3 |
PSA | 115.57000 | LogP | 6.34760 |
Solubility | N/A | Melting Point |
212-213 °C |
Formula | C26H45 N O5 S | Boiling Point | °Cat760mmHg |
Molecular Weight | 483.713 | Flash Point | °C |
Transport Information | N/A | Appearance | N/A |
Safety | Mutation data reported. When heated to decomposition it emits toxic vapors of NOx and SOx. | Risk Codes | N/A |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
Taurine,N-(3a-hydroxy-5b-cholan-24-oyl)- (8CI);Taurolithocholic acid (6CI,7CI); Cholane, ethanesulfonic acid deriv.; 3a-Hydroxy-5b-cholanoyltaurine; 3a-Hydroxy-N-(2-sulfoethyl)-5b-cholan-24-amide; Lithocholicacid taurine conjugate; Lithocholyltaurine |
Article Data | 4 |
Product Name: Taurolithocholic acid
CAS Registry Number: 516-90-5
IUPAC Name: 2-[[(4R)-4-[(3R,5R,8R,10S,13R,14S,17R)-3-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoyl]amino]ethanesulfonic acid
Molecular Weight: 483.7042 [g/mol]
Molecular Formula: C26H45NO5S
XLogP3-AA: 4.9
H-Bond Donor: 3
H-Bond Acceptor: 5
Surface Tension: 46.2 dyne/cm
Density: 1.169 g/cm3
Related Registry Number: 6042-32-6 (mono-hydrochloride salt)
Following is the molecular structure of Taurolithocholic acid (CAS NO.516-90-5) is:
Taurolithocholic acid (CAS NO.516-90-5) is a bile salt formed in the liver from lithocholic acid conjugation with taurine, usually as the sodium salt. It solubilizes fats for absorption and is itself absorbed. It is a cholagogue and choleretic.
1. | add-unr-lym 10 mg/L | CRNGDP Carcinogenesis. 15 (1994),1911. |
Mutation data reported. When heated to decomposition it emits toxic vapors of NOx and SOx.
Taurolithocholic acid , its cas register number is 516-90-5. It also can be called 2-(((3-alpha,5-beta)-3-Hydroxy-24-oxocholan-24-yl)amino)ethanesulfonic acid ; Lithocholic acid taurine conjugate ; Lithocholyltaurine ; Ethanesulfonic acid, 2-(((3-alpha,5-beta)-3-hydroxy-24-oxocholan-24-yl)amino)- ; Ethanesulfonic acid, 2-(((3alpha,5beta)-3-hydroxy-24-oxocholan-24-yl)amino)- ; Taurine, N-(3-alpha-hydroxy-5-beta-cholan-24-oyl)- (8CI) ; Taurolithocholic acid (6CI,7CI) .