Taurohyocholate

Base Information

Chemical Name:Taurohyocholate
CAS No.:32747-07-2
Molecular Formula:C₂₆H₄₅NO₇S
Molecular Weight:515.712
Hs Code.:
UNII:Z6K73MU7TF
Metabolomics Workbench ID:36994
Nikkaji Number:J563.909C
Wikidata:Q27123104

Synonyms:Taurohyocholate;taurohyocholic acid;32747-07-2;2-[[(4R)-4-[(3R,5R,6R,7S,8S,9S,10R,13R,14S,17R)-3,6,7-trihydroxy-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;2-[[(3alpha,5beta,6alpha,7alpha)-3,6,7-trihydroxy-24-oxocholan-24-yl]amino]-ethanesulfonicacid;N-(3alpha,6alpha,7alpha-Trihydroxy-5beta-cholan-24-oyl)-taurine;N-(3alpha,6alpha,7alpha-Trihydroxy-5beta-cholan-24-oyl)taurine;2-[[(3alpha,5beta,6alpha,7alpha)-3,6,7-Trihydroxy-24-oxocholan-24-yl]amino]ethanesulfonic acid;ST 24:1;O4;T;Taurine hyocholate;tauro-gamma-muricholic acid;Z6K73MU7TF;CHEBI:52022;LMST05040010;Q27123104;Taurine, N-(3alpha,6alpha,7alpha-trihydroxy-5beta-cholan-24-oyl)-;2-[(3alpha,6alpha,7alpha-trihydroxy-24-oxo-5beta-cholan-24-yl)amino]ethanesulfonic acid;2-[(4R)-4-[(1R,3aS,3bS,4S,5R,5aR,7R,9aR,9bS,11aR)-4,5,7-trihydroxy-9a,11a-dimethyl-hexadecahydro-1H-cyclopenta[a]phenanthren-1-yl]pentanamido]ethane-1-sulfonic acid;Ethanesulfonic acid, 2-[[(3alpha,5beta,6alpha,7alpha)-3,6,7-trihydroxy-24-oxocholan-24-yl]amino]-

Suppliers and Price of Taurohyocholate

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

TRC
2-[[(3α,5β,6α,7α)-3,6,7-Trihydroxy-24-oxocholan-24-yl]amino]ethanesulfonicacid
10mg
$ 160.00

Cayman Chemical
Taurohyocholate ≥95%
100mg
$ 536.00

Cayman Chemical
Taurohyocholate ≥95%
50mg
$ 283.00

Cayman Chemical
Taurohyocholate ≥95%
25mg
$ 149.00

Total 11 raw suppliers

Chemical Property of Taurohyocholate

Chemical Property:

XLogP3:2.6
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:7
Exact Mass:515.29167395
Heavy Atom Count:35
Complexity:891

Purity/Quality:

99% ^*data from raw suppliers

2-[[(3α,5β,6α,7α)-3,6,7-Trihydroxy-24-oxocholan-24-yl]amino]ethanesulfonicacid ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CC(CCC(=O)NCCS(=O)(=O)O)C1CCC2C1(CCC3C2C(C(C4C3(CCC(C4)O)C)O)O)C
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]2[C@@H]([C@@H]([C@H]4[C@@]3(CC[C@H](C4)O)C)O)O)C
Uses 2-[[(3α,5β,6α,7α)-3,6,7-Trihydroxy-24-oxocholan-24-yl]amino]ethanesulfonic acid is used in the research of bile salts.

Technology Process of Taurohyocholate

There total 20 articles about Taurohyocholate which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

: 107-35-7
Tau

: C₃₀H₃₉F₅O₅

: 25613-05-2,32747-07-2
tauro 3α,6β,7α-trihydroxy-5β-cholanoate

Guidance literature:: With 1,8-diazabicyclo[5.4.0]undec-7-ene; In dichloromethane; at 20 ℃; for 20h;
DOI:10.5012/bkcs.2013.34.8.2436

Reference yield:

: 107-35-7
Tau

: C₃₀H₃₉F₅O₅

: 25613-05-2,32747-07-2
tauro 3α,6α,7α-trihydroxy-5β-cholanoate

Guidance literature:: With 1,8-diazabicyclo[5.4.0]undec-7-ene; In dichloromethane; at 20 ℃; for 20h;
DOI:10.5012/bkcs.2013.34.8.2436

Reference yield:

: C₂₇H₄₄O₆

: 25613-05-2,32747-07-2
tauro 3α,6β,7α-trihydroxy-5β-cholanoate

Guidance literature:: Multi-step reaction with 3 steps

1: potassium hydroxide / methanol / 2 h / Reflux

2: 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride / dichloromethane; N,N-dimethyl-formamide / 20 h / 20 °C

3: 1,8-diazabicyclo[5.4.0]undec-7-ene / dichloromethane / 20 h / 20 °C

With 1,8-diazabicyclo[5.4.0]undec-7-ene; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; potassium hydroxide; In methanol; dichloromethane; N,N-dimethyl-formamide;
DOI:10.5012/bkcs.2013.34.8.2436