CAS 67030-59-5

Taurochenodeoxycholic acid 3-sulfate

Description:

Taurochenodeoxycholic acid 3-sulfate is a bile acid derivative that plays a significant role in the digestion and absorption of fats and fat-soluble vitamins in the intestine. It is a sulfated form of taurochenodeoxycholic acid, which is itself a conjugated bile acid formed from the amino acid taurine and chenodeoxycholic acid. This compound is characterized by its amphipathic nature, possessing both hydrophilic and hydrophobic properties, which allows it to interact effectively with lipids and facilitate their emulsification. The sulfate group enhances its solubility in aqueous environments, making it more effective in the gastrointestinal tract. Taurochenodeoxycholic acid 3-sulfate is involved in various physiological processes, including the regulation of cholesterol metabolism and the modulation of gut microbiota. Additionally, it may have implications in certain pathological conditions, such as liver diseases and metabolic disorders. Its CAS number, 67030-59-5, is a unique identifier that aids in the precise identification of this chemical substance in scientific literature and databases.

Formula: C₂₆H₄₅NO₉S₂

InChI: InChI=1S/C26H45NO9S2/c1-16(4-7-23(29)27-12-13-37(30,31)32)19-5-6-20-24-21(9-11-26(19,20)3)25(2)10-8-18(36-38(33,34)35)14-17(25)15-22(24)28/h16-22,24,28H,4-15H2,1-3H3,(H,27,29)(H,30,31,32)(H,33,34,35)/t16-,17+,18-,19-,20+,21+,22-,24+,25+,26-/m1/s1

InChI key: InChIKey=GLVWZDCWCRWVFM-BJLOMENOSA-N

SMILES: C[C@@]12[C@@]3([C@]([C@]4([C@](C)(CC3)[C@@]([C@@H](CCC(NCCS(=O)(=O)O)=O)C)(CC4)[H])[H])([C@H](O)C[C@@]1(C[C@H](OS(=O)(=O)O)CC2)[H])[H])[H]

Synonyms:

• Ethanesulfonic acid, 2-[[(3α,5β,7α)-7-hydroxy-24-oxo-3-(sulfooxy)cholan-24-yl]amino]-
• 2-[[(3α,5β,7α)-7-Hydroxy-24-oxo-3-(sulfooxy)cholan-24-yl]amino]ethanesulfonic acid
• Taurochenodeoxycholic acid 3-sulfate
• Taurochenodeoxycholic acid 3α-sulfate
• Cholane, ethanesulfonic acid deriv.

Taurochenodeoxycholate-3-sulfate

CAS: 67030-59-5

Taurochenodeoxycholate-3-sulfate

Purity: ≥95%

Molecular weight: 579.77g/mol

Ref: 54-BUP21716

Taurochenodeoxycholate-3-sulfate

CAS: 67030-59-5

Taurochenodeoxycholate-3-sulfate (TCDCS) is a top-ranking classifier on the receiver operating characteristic curve for severe and non-severe COVID-19 patients.

Formula: C₂₆H₄₅NO₉S₂

Purity: 98% - 98%

Color and Shape: Solid

Molecular weight: 579.77

Ref: TM-T13916

Taurochenodeoxycholate-3-sulfate

CAS: 67030-59-5

Taurochenodeoxycholate-3-sulfate is a conjugate of taurochenodeoxycholic acid and 3-sulfate. It is a bile acid that has been used in clinical studies to determine the transport properties of unconjugated taurochenodeoxycholic acid. Taurochenodeoxycholate-3-sulfate has an inhibitory effect on the uptake of dinucleotide phosphate and fatty acids by cells, which may be due to its ability to bind to plasma membrane receptors. This drug also has a role in the metabolism of drugs and other xenobiotics. Taurochenodeoxycholate-3-sulfate is found in urine samples from humans, although it can also be detected in breast milk, amniotic fluid and tissue biopsies. In rats, this drug has been shown to have an influence on body mass index and metabolic profiles.

Formula: C₂₆H₄₅NO₉S₂

Purity: Min. 95%

Color and Shape: Powder

Molecular weight: 579.77 g/mol

Ref: 3D-SCA03059