ADP-ribose 2'-phosphate
TL;DR: ADP-ribose 2'-phosphate (CAS 4197-14-2) is a chemical compound with molecular formula C15H24N5O17P3 and molecular weight 639.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[[(2R,3R,4R,5R)-5-(6-aminopurin-9-yl)-3-hydroxy-4-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2S,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl] hydrogen phosphate
Also Known As: ADP-ribose 2'-phosphate, ADPribose 2'-phosphate, 2'-phospho-ADP-ribose, adenosine diphosphate ribose, ADP-D-ribose 2'-phosphate
| Molecular Formula | C15H24N5O17P3 |
|---|---|
| Molecular Weight | 639.04 g/mol |
| LogP | -6.7 |
| Topological Polar Surface Area | 338.0 Ų |
| Hydrogen Bond Donors | 9 |
| Hydrogen Bond Acceptors | 21 |
| Rotatable Bonds | 11 |
| Exact Mass | 639.038 |
| Heavy Atoms | 40 |
| Complexity | 1040.0 |
Chemical Identifiers
| CAS Number | 4197-14-2 |
|---|---|
| SMILES | C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)OP(=O)(O)O[C@H]4[C@@H]([C@@H]([C@H](O4)CO)O)O)O)OP(=O)(O)O)N |
| InChIKey | OCOLIMYIUOUURJ-ZQSHOCFMSA-N |
Product Overview
ADP-ribose 2'-phosphate (CAS 4197-14-2), with molecular formula C15H24N5O17P3 and molecular weight 639.04 g/mol. IUPAC: [[(2R,3R,4R,5R)-5-(6-aminopurin-9-yl)-3-hydroxy-4-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2S,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl] hydrogen phosphate.
Chemical Property Profile of ADP-ribose 2'-phosphate
Property Insights of ADP-ribose 2'-phosphate
The XLogP value of -6.7 indicates that ADP-ribose 2'-phosphate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 338.0 Ų indicates high polarity, suggesting ADP-ribose 2'-phosphate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, ADP-ribose 2'-phosphate has 9 hydrogen bond donor(s) and 21 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ADP-ribose 2'-phosphate?
The CAS number of ADP-ribose 2'-phosphate is 4197-14-2.
What is the molecular formula of ADP-ribose 2'-phosphate?
The molecular formula of ADP-ribose 2'-phosphate is C15H24N5O17P3.
What is the molecular weight of ADP-ribose 2'-phosphate?
The molecular weight of ADP-ribose 2'-phosphate is 639.04 g/mol.
Where can I buy ADP-ribose 2'-phosphate?
You can request a quote for ADP-ribose 2'-phosphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ADP-ribose 2'-phosphate?
Yes, KEHONG BIO provides custom synthesis services for ADP-ribose 2'-phosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.