Ethenoadenosine triphosphate-2',3'-dialdehyde
TL;DR: Ethenoadenosine triphosphate-2',3'-dialdehyde (CAS 84185-83-1) is a chemical compound with molecular formula C12H14N5O13P3 and molecular weight 528.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[hydroxy-[(2R)-2-[(1R)-1-imidazo[2,1-f]purin-3-yl-2-oxoethoxy]-3-oxopropoxy]phosphoryl] phosphono hydrogen phosphate
Also Known As: Dial-epsilon ATP, 2',3'-Dialdehyde etheno-ATP, Ethenoadenosine triphosphate-2',3'-dialdehyde, 3-hydroxy-6-(4-methylphenyl)phthalic acid, [hydroxy-[(2R)-2-[(1R)-1-imidazo[2,1-f]purin-3-yl-2-oxoethoxy]-3-oxopropoxy]phosphoryl] phosphono hydrogen phosphate
| Molecular Formula | C12H14N5O13P3 |
|---|---|
| Molecular Weight | 528.98 g/mol |
| LogP | -0.2961 |
| Topological Polar Surface Area | 251.2 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 12 |
| Exact Mass | 528.9801 |
| Heavy Atoms | 33 |
| Complexity | 1316.8181 |
Chemical Identifiers
| CAS Number | 84185-83-1 |
|---|---|
| SMILES | C1=CN2C=NC3=C(C2=N1)N=CN3[C@@H](C=O)O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C=O |
Product Overview
Ethenoadenosine triphosphate-2',3'-dialdehyde (CAS 84185-83-1), with molecular formula C12H14N5O13P3 and molecular weight 528.98 g/mol. IUPAC: [hydroxy-[(2R)-2-[(1R)-1-imidazo[2,1-f]purin-3-yl-2-oxoethoxy]-3-oxopropoxy]phosphoryl] phosphono hydrogen phosphate.
Chemical Property Profile of Ethenoadenosine triphosphate-2',3'-dialdehyde
Property Insights of Ethenoadenosine triphosphate-2',3'-dialdehyde
The XLogP value of -0.2961 indicates that Ethenoadenosine triphosphate-2',3'-dialdehyde is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 251.2 Ų indicates high polarity, suggesting Ethenoadenosine triphosphate-2',3'-dialdehyde may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Ethenoadenosine triphosphate-2',3'-dialdehyde has 4 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ethenoadenosine triphosphate-2',3'-dialdehyde?
The CAS number of Ethenoadenosine triphosphate-2',3'-dialdehyde is 84185-83-1.
What is the molecular formula of Ethenoadenosine triphosphate-2',3'-dialdehyde?
The molecular formula of Ethenoadenosine triphosphate-2',3'-dialdehyde is C12H14N5O13P3.
What is the molecular weight of Ethenoadenosine triphosphate-2',3'-dialdehyde?
The molecular weight of Ethenoadenosine triphosphate-2',3'-dialdehyde is 528.98 g/mol.
Where can I buy Ethenoadenosine triphosphate-2',3'-dialdehyde?
You can request a quote for Ethenoadenosine triphosphate-2',3'-dialdehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethenoadenosine triphosphate-2',3'-dialdehyde?
Yes, KEHONG BIO provides custom synthesis services for Ethenoadenosine triphosphate-2',3'-dialdehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.