CMP-Neu5Ac
TL;DR: CMP-Neu5Ac (CAS 1007117-62-5) is a chemical compound with molecular formula C20H31N4O16P and molecular weight 614.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R,4S,5R,6R)-5-acetamido-2-[[(2R,3S,4R,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-4-hydroxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylic acid
Also Known As: CMP-Sialic acid, Cmp-nana, CMP Sialic acid, CMP-Neu5Ac, CMP-N-acetylneuraminate
| Molecular Formula | C20H31N4O16P |
|---|---|
| Molecular Weight | 614.15 g/mol |
| LogP | -6.7 |
| Topological Polar Surface Area | 321.0 Ų |
| Hydrogen Bond Donors | 10 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 11 |
| Exact Mass | 614.1473 |
| Heavy Atoms | 41 |
| Complexity | 1120.0 |
Chemical Identifiers
| CAS Number | 1007117-62-5 |
|---|---|
| SMILES | CC(=O)N[C@@H]1[C@H](C[C@](O[C@H]1[C@@H]([C@@H](CO)O)O)(C(=O)O)OP(=O)(O)OC[C@@H]2[C@H]([C@H]([C@@H](O2)N3C=CC(=NC3=O)N)O)O)O |
| InChIKey | TXCIAUNLDRJGJZ-BILDWYJOSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
CMP-Neu5Ac (CAS 1007117-62-5), with molecular formula C20H31N4O16P and molecular weight 614.15 g/mol. IUPAC: (2R,4S,5R,6R)-5-acetamido-2-[[(2R,3S,4R,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-4-hydroxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylic acid.
Chemical Property Profile of CMP-Neu5Ac
Property Insights of CMP-Neu5Ac
The XLogP value of -6.7 indicates that CMP-Neu5Ac is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 321.0 Ų indicates high polarity, suggesting CMP-Neu5Ac may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, CMP-Neu5Ac has 10 hydrogen bond donor(s) and 16 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of CMP-Neu5Ac?
The CAS number of CMP-Neu5Ac is 1007117-62-5.
What is the molecular formula of CMP-Neu5Ac?
The molecular formula of CMP-Neu5Ac is C20H31N4O16P.
What is the molecular weight of CMP-Neu5Ac?
The molecular weight of CMP-Neu5Ac is 614.15 g/mol.
Where can I buy CMP-Neu5Ac?
You can request a quote for CMP-Neu5Ac directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CMP-Neu5Ac?
Yes, KEHONG BIO provides custom synthesis services for CMP-Neu5Ac and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.