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Deoxycholylglycine structure
Fine Chemical

Deoxycholylglycine

TL;DR: Deoxycholylglycine (CAS 16223-63-5) is a chemical compound with molecular formula C26H45NO4 and molecular weight 435.33487 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2-[4-[(3R,5R,10R,12S,13R)-3,12-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]pentylamino]acetic acid

Also Known As: Deoxycholylglycine, glycodeoxycholic acid, Glycodesoxycholic acid, Glykodesoxycholsaeure [German], Glycodeoxycholic acid monohydrate

CAS Number
16223-63-5
Molecular Formula
C26H45NO4
Molecular Weight
435.33487 g/mol
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Technical Specifications

Molecular FormulaC26H45NO4
Molecular Weight435.33487 g/mol
XLogP2.7
Topological Polar Surface Area (TPSA)89.8 Ų
Hydrogen Bond Donors4
Hydrogen Bond Acceptors5
Rotatable Bonds7
Exact Mass435.33487 Da
Heavy Atoms31
Complexity655.0
SMILESCC(CCCNCC(=O)O)C1CCC2[C@@]1([C@H](CC3C2CC[C@H]4[C@]3(CC[C@H](C4)O)C)O)C
InChIKeySJBHFAAZLAILHS-QJEGWHEBSA-N

Product Description

Applications: Deoxycholylglycine is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Deoxycholylglycine (CAS 16223-63-5) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.

A fine chemical supplied by CoreyChem, Deoxycholylglycine (CAS 16223-63-5) has the molecular formula C26H45NO4 and a molecular weight of 435.33 g/mol. It is also known as Deoxycholylglycine and glycodeoxycholic acid.

Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.

Chemical Property Profile of Deoxycholylglycine

XLogP
2.7
TPSA (Topological Polar Surface Area)
89.8
Hydrogen Bond Donors
4
Hydrogen Bond Acceptors
5
Rotatable Bonds
7
Heavy Atoms
31
Complexity
655.0
Exact Mass
435.33487
Monoisotopic Mass
435.33487
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of Deoxycholylglycine

The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Deoxycholylglycine. The TPSA of 89.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Deoxycholylglycine. Following Lipinski's Rule of Five, Deoxycholylglycine has 4 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of Deoxycholylglycine?

The CAS number of Deoxycholylglycine is 16223-63-5.

What is the molecular formula of Deoxycholylglycine?

The molecular formula of Deoxycholylglycine is C26H45NO4.

What is the molecular weight of Deoxycholylglycine?

The molecular weight of Deoxycholylglycine is 435.33487 g/mol.

What are the applications of Deoxycholylglycine?

Deoxycholylglycine is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Deoxycholylglycine (CAS 16223-63-5) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS,...

Where can I buy Deoxycholylglycine?

You can request a quote for Deoxycholylglycine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Deoxycholylglycine?

Yes, CoreyChem provides custom synthesis services for Deoxycholylglycine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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