Sodium taurohyodeoxycholate hydrate - ≥97% , CAS No.38411-85-7

CAS: 38411-85-7 Cat. No.: S303613 Molecular Weight: 521.69（anhydrous） PubChem CID: 90478527

GRADE & PURITY ≥97%

Synonyms

MFCD00271496 | ETHANESULFONIC ACID, 2-(((3.ALPHA.,5.BETA.,6.ALPHA.)-3,6-DIHYDROXY-24-OXOCHOLAN-24-YL)AMINO)-, SODIUM SALT (1:1) | UNII-4N9535CHEK | HY-114360A | Q27260244 | Taurodeoxychloic Acid (sodium hydrate) | Taurohyodeoxycholic acid sodium salt hydr

Storage

Store at 2-8°C,Desiccated

Shipped In

Wet ice

Overview

product description：

Sodium taurohyodeoxycholate hydrate is a taurine-amidated bile salt, which can be used as an anionic detergent.

application：

Sodium taurohyodeoxycholate hydrate has been used in a study to assess dose-response data for cytotoxicity, regenerative cell proliferation and secondary oxidative DNA damage in rat livers treated with furan. It has also been used in a study to investigate the use of an immobilized artificial membrane HPLC column to predict bile salt-membrane interactions.

Specifications

Synonyms

MFCD00271496 | ETHANESULFONIC ACID, 2-(((3.ALPHA., 5.BETA., 6.ALPHA.)-3, 6-DIHYDROXY-24-OXOCHOLAN-24-YL)AMINO)-, SODIUM SALT (1:1) | UNII-4N9535CHEK | HY-114360A | Q27260244 | Taurodeoxychloic Acid (sodium hydrate) | Taurohyodeoxycholic acid sodium salt hydr

Specifications & Purity

≥97%

Storage

Store at 2-8°C, Desiccated

Shipped In

Wet ice

This product requires cold chain shipping. Ground and other economy services are not available.

Purity

≥97%

Names and Identifiers

• Pubchem Sid: 504772596
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504772596
• Canonical Smiles: CC(CCC(=O)NCCS(=O)(=O)[O-])C1CCC2C1(CCC3C2CC(C4C3(CCC(C4)O)C)O)C.[Na+]
• IUPAC Name: sodium;2-[[(4R)-4-[(3R,5R,6S,8S,9S,10R,13R,14S,17R)-3,6-dihydroxy-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]ethanesulfonate
• InChIKey: VNQXUJQHLHHTRC-WMWRQJSFSA-M
• INCHI: 1S/C26H45NO6S.Na/c1-16(4-7-24(30)27-12-13-34(31,32)33)19-5-6-20-18-15-23(29)22-14-17(28)8-10-26(22,3)21(18)9-11-25(19,20)2;/h16-23,28-29H,4-15H2,1-3H3,(H,27,30)(H,31,32,33);/q;+1/p-1/t16-,17-,18+,19-,20+,21+,22+,23+,25-,26-;/m1./s1
• Isomeric SMILES: C[C@H](CCC(=O)NCCS(=O)(=O)[O-])[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2C[C@@H]([C@H]4[C@@]3(CC[C@H](C4)O)C)O)C.[Na+]
• PubChem CID: 90478527
• Molecular Weight: 521.69（anhydrous）

Chemical and Physical Properties

• Molecular Weight: 521.700 g/mol
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 7
• Exact Mass: 521.279 Da
• Monoisotopic Mass: 521.279 Da
• Topological Polar Surface Area: 135.000 Ų
• Heavy Atom Count: 35
• Formal Charge: 0
• Complexity: 864.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 10
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 2

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