二腺苷三磷酸
TL;DR: 二腺苷三磷酸 (CAS 158700-26-6) is a chemical compound with molecular formula C20H27N10O16P3 and molecular weight 756.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
二腺苷三磷酸
bis[[5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] hydrogen phosphate
Also Known As: ApppA, AP3A-lyophilized, diadenosine triphosphate, 5'Ap3A, BIS(ADENOSINE)-5'-TRIPHOSPHATE
| Molecular Formula | C20H27N10O16P3 |
|---|---|
| Molecular Weight | 756.08 g/mol |
| LogP | -7.2 |
| Topological Polar Surface Area | 387.0 Ų |
| Hydrogen Bond Donors | 9 |
| Hydrogen Bond Acceptors | 24 |
| Rotatable Bonds | 12 |
| Exact Mass | 756.0819 |
| Heavy Atoms | 49 |
| Complexity | 1240.0 |
Chemical Identifiers
| CAS Number | 158700-26-6 |
|---|---|
| SMILES | C1=NC(=C2C(=N1)N(C=N2)C3C(C(C(O3)COP(=O)(O)OP(=O)(O)OP(=O)(O)OCC4C(C(C(O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O)N |
| InChIKey | QCICUPZZLIQAPA-UHFFFAOYSA-N |
Product Overview
二腺苷三磷酸 (CAS 158700-26-6), with molecular formula C20H27N10O16P3 and molecular weight 756.08 g/mol. IUPAC: bis[[5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] hydrogen phosphate.
Chemical Property Profile of 二腺苷三磷酸
Property Insights of 二腺苷三磷酸
The XLogP value of -7.2 indicates that 二腺苷三磷酸 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 387.0 Ų indicates high polarity, suggesting 二腺苷三磷酸 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 二腺苷三磷酸 has 9 hydrogen bond donor(s) and 24 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 二腺苷三磷酸?
The CAS number of 二腺苷三磷酸 is 158700-26-6.
What is the molecular formula of 二腺苷三磷酸?
The molecular formula of 二腺苷三磷酸 is C20H27N10O16P3.
What is the molecular weight of 二腺苷三磷酸?
The molecular weight of 二腺苷三磷酸 is 756.08 g/mol.
Where can I buy 二腺苷三磷酸?
You can request a quote for 二腺苷三磷酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 二腺苷三磷酸?
Yes, KEHONG BIO provides custom synthesis services for 二腺苷三磷酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.