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Chemistry

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Also known as: Sehcat, 75018-71-2, H6630pu5zj, Unii-h6630pu5zj, Tauroselcholic acid [inn:ban], 2-[[2-[(2s)-2-[(3r,5s,7r,8r,9s,10s,12s,13s,14s,17r)-3,7,12-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]propyl]selanylacetyl]amino]ethanesulfonic acid
Molecular Formula
C26H45NO7SSe
Molecular Weight
594.7  g/mol
InChI Key
JCMLWGQJPSGGEI-HZAMXZRMSA-N
FDA UNII
H6630PU5ZJ

Tauroselcholic Acid
1 2D Structure

Tauroselcholic Acid

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
2-[[2-[(2S)-2-[(3R,5S,7R,8R,9S,10S,12S,13S,14S,17R)-3,7,12-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]propyl]selanylacetyl]amino]ethanesulfonic acid
2.1.2 InChI
InChI=1S/C26H45NO7SSe/c1-15(13-36-14-23(31)27-8-9-35(32,33)34)18-4-5-19-24-20(12-22(30)26(18,19)3)25(2)7-6-17(28)10-16(25)11-21(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
2.1.3 InChI Key
JCMLWGQJPSGGEI-HZAMXZRMSA-N
2.1.4 Canonical SMILES
CC(C[Se]CC(=O)NCCS(=O)(=O)O)C1CCC2C1(C(CC3C2C(CC4C3(CCC(C4)O)C)O)O)C
2.1.5 Isomeric SMILES
C[C@H](C[Se]CC(=O)NCCS(=O)(=O)O)[C@H]1CC[C@@H]2[C@@]1([C@H](C[C@H]3[C@H]2[C@@H](C[C@H]4[C@@]3(CC[C@H](C4)O)C)O)O)C
2.2 Other Identifiers
2.2.1 UNII
H6630PU5ZJ
2.3 Synonyms
2.3.1 MeSH Synonyms

1. (75)seleno-homocholic Acid-taurine

2. 23-seleno-25-homotaurocholic Acid

3. Se(75)hcat

4. Se-hcat

5. Sehcat

6. Selenium-75 Homocholic Acid Taurine

7. Tauro-23-selena-25-homotaurocholic Acid

2.3.2 Depositor-Supplied Synonyms

1. Sehcat

2. 75018-71-2

3. H6630pu5zj

4. Unii-h6630pu5zj

5. Tauroselcholic Acid [inn:ban]

6. 2-[[2-[(2s)-2-[(3r,5s,7r,8r,9s,10s,12s,13s,14s,17r)-3,7,12-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]propyl]selanylacetyl]amino]ethanesulfonic Acid

7. Schembl2110397

8. Chembl3707263

9. Tauroselcholic Acid [inn]

10. Dtxsid701028204

11. Tauroselcholic Acid [who-dd]

12. Q27888350

13. N-((((20s)-3.alpha.,7.alpha.,12.alpha.-trihydroxy-20-methyl-5.beta.-pregnan-21-yl)selenyl)acetyl)taurine

14. N-((((20s)-3alpha,7alpha,12alpha-trihydroxy-20-methyl-5beta-pregnan-21-yl)selenyl)acetyl)taurine

2.4 Create Date
2005-08-09
3 Chemical and Physical Properties
Molecular Weight 594.7 g/mol
Molecular Formula C26H45NO7SSe
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count7
Rotatable Bond Count8
Exact Mass595.20820 g/mol
Monoisotopic Mass595.20820 g/mol
Topological Polar Surface Area153 Ų
Heavy Atom Count36
Formal Charge0
Complexity913
Isotope Atom Count0
Defined Atom Stereocenter Count11
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1

ABOUT THIS PAGE

Tauroselcholic Acid Manufacturers

A Tauroselcholic Acid manufacturer is defined as any person or entity involved in the manufacture, preparation, processing, compounding or propagation of Tauroselcholic Acid, including repackagers and relabelers. The FDA regulates Tauroselcholic Acid manufacturers to ensure that their products comply with relevant laws and regulations and are safe and effective to use. Tauroselcholic Acid API Manufacturers are required to adhere to Good Manufacturing Practices (GMP) to ensure that their products are consistently manufactured to meet established quality criteria.

Tauroselcholic Acid Suppliers

A Tauroselcholic Acid supplier is an individual or a company that provides Tauroselcholic Acid active pharmaceutical ingredient (API) or Tauroselcholic Acid finished formulations upon request. The Tauroselcholic Acid suppliers may include Tauroselcholic Acid API manufacturers, exporters, distributors and traders.

Tauroselcholic Acid GMP

Tauroselcholic Acid Active pharmaceutical ingredient (API) is produced in GMP-certified manufacturing facility.

GMP stands for Good Manufacturing Practices, which is a system used in the pharmaceutical industry to make sure that goods are regularly produced and monitored in accordance with quality standards. The FDA’s current Good Manufacturing Practices requirements are referred to as cGMP or current GMP which indicates that the company follows the most recent GMP specifications. The World Health Organization (WHO) has its own set of GMP guidelines, called the WHO GMP. Different countries can also set their own guidelines for GMP like China (Chinese GMP) or the EU (EU GMP).

PharmaCompass offers a list of Tauroselcholic Acid GMP manufacturers, exporters & distributors, which can be sorted by USDMF, JDMF, KDMF, CEP (COS), WC, API price, and more, enabling you to easily find the right Tauroselcholic Acid GMP manufacturer or Tauroselcholic Acid GMP API supplier for your needs.

Tauroselcholic Acid CoA

A Tauroselcholic Acid CoA (Certificate of Analysis) is a formal document that attests to Tauroselcholic Acid's compliance with Tauroselcholic Acid specifications and serves as a tool for batch-level quality control.

Tauroselcholic Acid CoA mostly includes findings from lab analyses of a specific batch. For each Tauroselcholic Acid CoA document that a company creates, the USFDA specifies specific requirements, such as supplier information, material identification, transportation data, evidence of conformity and signature data.

Tauroselcholic Acid may be tested according to a variety of international standards, such as European Pharmacopoeia (Tauroselcholic Acid EP), Tauroselcholic Acid JP (Japanese Pharmacopeia) and the US Pharmacopoeia (Tauroselcholic Acid USP).

Inform the supplier about your product requirements, specifying if you need a product with particular monograph like EP (Ph. Eur.), USP, JP, BP, or any other quality. In addition, clarify whether you need hydrochloride (HCl), anhydricum, base, micronisatum or a specific level of purity. To find reputable suppliers, utilize the filters and select those certified by GMP, FDA, or any other certification as per your requirement.
For your convenience, we have listed synonyms and CAS numbers to help you find the best supplier. The use of synonyms and CAS numbers can be helpful in identifying potential suppliers, but it is crucial to note that they might not always indicate the exact same product. It is important to confirm the product details with the supplier before making a purchase to ensure that it meets your requirements.
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