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Ethanesulfonic acid,2-[[(3a,5b,7a,12a)-3,7,12-trihydroxy-24-oxocholan-24-yl]amino]- (81-24-3)

Identification
Name:Ethanesulfonic acid,2-[[(3a,5b,7a,12a)-3,7,12-trihydroxy-24-oxocholan-24-yl]amino]-
Synonyms:Taurine,N-choloyl- (8CI); Cholane, ethanesulfonic acid deriv.; 3a,7a,12a-Trihydroxy-5b-cholanic acid-24-taurine; Cholaic acid; Cholic acid taurine conjugate;Cholyltaurine; N-Choloyltaurine; NSC 25505; Taurocholic acid
CAS:81-24-3
EINECS: 201-336-2
Molecular Formula: C26H45 N O7 S
Molecular Weight: 515.78
InChI: InChI=1/C26H45NO7S/c1-15(4-7-23(31)27-10-11-35(32,33)34)18-5-6-19-24-20(14-22(30)26(18,19)3)25(2)9-8-17(28)12-16(25)13-21(24)29/h15-22,24,28-30H,4-14H2,1-3H3,(H,27,31)(H,32,33,34)/t15-,16+,17-,18-,19+,20+,21-,22+,24?,25+,26-/m1/s1
Molecular Structure: (C26H45NO7S) Taurine,N-choloyl- (8CI); Cholane, ethanesulfonic acid deriv.; 3a,7a,12a-Trihydroxy-5b-cholanic acid...
Properties
Melting Point: 1.264 g/cm3
Refractive index:1.565
Solubility:SOL IN ETHYL ACETATE, CHLOROFORM
SLIGHTLY SOL IN WATER, ALC, ETHER, MINERAL OILS
SLIGHTLY SOL IN FATS
1 G SOL IN 10 ML ACETONE & 10 ML 0.5 N NAOH
PRACTICALLY INSOL IN SOLVENT HEXANE
SPARINGLY SOL IN DILUTE ALKALI
Specification:

 Taurocholic acid, known also as cholaic acid, cholyltaurine, or acidum cholatauricum, is a deliquescent yellowish crystalline bile acid involved in the emulsification of fats. It occurs as a sodium salt in the bile of mammals. It is a conjugate of cholic acid with taurine.

Color: WHITE TO OFF-WHITE
Safety Data
 

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