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Adenosine triphosphopyridoxal structure
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Adenosine triphosphopyridoxal

TL;DR: Adenosine triphosphopyridoxal (CAS 101418-86-4) is a chemical compound with molecular formula C18H23N6O15P3 and molecular weight 656.0434 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(4-formyl-5-hydroxy-6-methyl-3-pyridinyl)methoxy-hydroxyphosphoryl] hydrogen phosphate

Also Known As: Adenosine triphosphopyridoxal, AP3-PL, (2-methylthiophenylazo)-p-toluene, Pyridoxal 5 -triphosphoadenosine, J1.419.397I

CAS Number
101418-86-4
Molecular Formula
C18H23N6O15P3
Molecular Weight
656.0434 g/mol
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Technical Specifications

Molecular FormulaC18H23N6O15P3
Molecular Weight656.0434 g/mol
XLogP-4.7
Topological Polar Surface Area (TPSA)318.0 Ų
Hydrogen Bond Donors7
Hydrogen Bond Acceptors20
Rotatable Bonds12
Exact Mass656.0434 Da
Heavy Atoms42
Complexity1110.0
SMILESCC1=NC=C(C(=C1O)C=O)COP(=O)(O)OP(=O)(O)OP(=O)(O)OC[C@@H]2[C@H]([C@H]([C@@H](O2)N3C=NC4=C(N=CN=C43)N)O)O
InChIKeyDGTZIRGKHKQBEL-XKLVTHTNSA-N

Product Description

Applications: Adenosine triphosphopyridoxal is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).

A fine chemical supplied by CoreyChem, Adenosine triphosphopyridoxal (CAS 101418-86-4) has the molecular formula C18H23N6O15P3 and a molecular weight of 656.04 g/mol. Synonyms include Adenosine triphosphopyridoxal and AP3-PL.

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 Adenosine triphosphopyridoxal

XLogP
-4.7
TPSA (Topological Polar Surface Area)
318.0
Hydrogen Bond Donors
7
Hydrogen Bond Acceptors
20
Rotatable Bonds
12
Heavy Atoms
42
Complexity
1110.0
Exact Mass
656.0434
Monoisotopic Mass
656.0434
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 Adenosine triphosphopyridoxal

The XLogP value of -4.7 indicates that Adenosine triphosphopyridoxal is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 318.0 Ų indicates high polarity, suggesting Adenosine triphosphopyridoxal may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Adenosine triphosphopyridoxal has 7 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 Adenosine triphosphopyridoxal?

The CAS number of Adenosine triphosphopyridoxal is 101418-86-4.

What is the molecular formula of Adenosine triphosphopyridoxal?

The molecular formula of Adenosine triphosphopyridoxal is C18H23N6O15P3.

What is the molecular weight of Adenosine triphosphopyridoxal?

The molecular weight of Adenosine triphosphopyridoxal is 656.0434 g/mol.

What are the applications of Adenosine triphosphopyridoxal?

Adenosine triphosphopyridoxal is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS,...

Where can I buy Adenosine triphosphopyridoxal?

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

Does CoreyChem offer custom synthesis for Adenosine triphosphopyridoxal?

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

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