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desulfo-coenzyme a structure
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desulfo-coenzyme a

TL;DR: desulfo-coenzyme a (CAS 5863-40-1) is a chemical compound with molecular formula C21H36N7O16P3 and molecular weight 735.1431 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

[[5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [4-[[3-(ethylamino)-3-oxopropyl]amino]-3-hydroxy-2,2-dimethyl-4-oxobutyl] hydrogen phosphate

Also Known As: desulfo-coenzyme a, Desulfo-coa, Dethiocoenzyme A, Coenzyme A, desulfo, Desulfocoenzyme A lithium salt

CAS Number
5863-40-1
Molecular Formula
C21H36N7O16P3
Molecular Weight
735.1431 g/mol
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Technical Specifications

Molecular FormulaC21H36N7O16P3
Molecular Weight735.1431 g/mol
XLogP-5.7
Topological Polar Surface Area (TPSA)347.0 Ų
Hydrogen Bond Donors9
Hydrogen Bond Acceptors20
Rotatable Bonds17
Exact Mass735.1431 Da
Heavy Atoms47
Complexity1240.0
SMILESCCNC(=O)CCNC(=O)C(C(C)(C)COP(=O)(O)OP(=O)(O)OCC1C(C(C(O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)O)O
InChIKeyILWZMFJBPIYQKW-UHFFFAOYSA-N

Product Description

Applications: desulfo-coenzyme a is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies desulfo-coenzyme a (CAS 5863-40-1) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.

desulfo-coenzyme a (CAS 5863-40-1) is a fine chemical with the molecular formula C21H36N7O16P3 and a molecular weight of 735.14 g/mol. It is also known as desulfo-coenzyme a and Desulfo-coa.

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 desulfo-coenzyme a

XLogP
-5.7
TPSA (Topological Polar Surface Area)
347.0
Hydrogen Bond Donors
9
Hydrogen Bond Acceptors
20
Rotatable Bonds
17
Heavy Atoms
47
Complexity
1240.0
Exact Mass
735.1431
Monoisotopic Mass
735.1431
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 desulfo-coenzyme a

The XLogP value of -5.7 indicates that desulfo-coenzyme a is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 347.0 Ų indicates high polarity, suggesting desulfo-coenzyme a may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, desulfo-coenzyme a has 9 hydrogen bond donor(s) and 20 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of desulfo-coenzyme a?

The CAS number of desulfo-coenzyme a is 5863-40-1.

What is the molecular formula of desulfo-coenzyme a?

The molecular formula of desulfo-coenzyme a is C21H36N7O16P3.

What is the molecular weight of desulfo-coenzyme a?

The molecular weight of desulfo-coenzyme a is 735.1431 g/mol.

What are the applications of desulfo-coenzyme a?

desulfo-coenzyme a is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies desulfo-coenzyme a (CAS 5863-40-1) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and...

Where can I buy desulfo-coenzyme a?

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

Does CoreyChem offer custom synthesis for desulfo-coenzyme a?

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

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