3-脱氮鸟苷酸
TL;DR: 3-脱氮鸟苷酸 (CAS 56039-13-5) is a chemical compound with molecular formula C11H15N4O8P and molecular weight 362.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-脱氮鸟苷酸
[(2R,3S,4R,5R)-5-(6-amino-4-oxo-5H-imidazo[4,5-c]pyridin-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate
Also Known As: 3-Deazaguanylic acid, 3-Deazaguanosine-5'-phosphate, J1.876.661B, [(2R,3S,4R,5R)-5-(6-amino-4-oxo-5H-imidazo[4,5-c]pyridin-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate, 1-(5-O-Phosphono-beta-D-ribofuranosyl)-6-amino-1H-imidazo[4,5-c]pyridine-4(5H)-one
| Molecular Formula | C11H15N4O8P |
|---|---|
| Molecular Weight | 362.06 g/mol |
| LogP | -3.9 |
| Topological Polar Surface Area | 189.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 4 |
| Exact Mass | 362.06274 |
| Heavy Atoms | 24 |
| Complexity | 597.0 |
Chemical Identifiers
| CAS Number | 56039-13-5 |
|---|---|
| SMILES | C1=C(NC(=O)C2=C1N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)O)O)O)N |
| InChIKey | SMOXFGDCBYPWTB-MGUDNFKCSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-脱氮鸟苷酸 (CAS 56039-13-5), with molecular formula C11H15N4O8P and molecular weight 362.06 g/mol. IUPAC: [(2R,3S,4R,5R)-5-(6-amino-4-oxo-5H-imidazo[4,5-c]pyridin-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate.
Chemical Property Profile of 3-脱氮鸟苷酸
Property Insights of 3-脱氮鸟苷酸
The XLogP value of -3.9 indicates that 3-脱氮鸟苷酸 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 189.0 Ų indicates high polarity, suggesting 3-脱氮鸟苷酸 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 3-脱氮鸟苷酸 has 6 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-脱氮鸟苷酸?
The CAS number of 3-脱氮鸟苷酸 is 56039-13-5.
What is the molecular formula of 3-脱氮鸟苷酸?
The molecular formula of 3-脱氮鸟苷酸 is C11H15N4O8P.
What is the molecular weight of 3-脱氮鸟苷酸?
The molecular weight of 3-脱氮鸟苷酸 is 362.06 g/mol.
Where can I buy 3-脱氮鸟苷酸?
You can request a quote for 3-脱氮鸟苷酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-脱氮鸟苷酸?
Yes, KEHONG BIO provides custom synthesis services for 3-脱氮鸟苷酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.