N-Acetyl-alpha-aspartylglutamic acid
TL;DR: N-Acetyl-alpha-aspartylglutamic acid (CAS 3106-85-2) is a chemical compound with molecular formula C11H16N2O8 and molecular weight 304.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2-acetamido-3-carboxypropanoyl)amino]pentanedioic acid
Also Known As: spaglumic acid, Isospaglumic acid, N-Acetyl-Asp-Glu, alpha-NAAG, NAAG
| Molecular Formula | C11H16N2O8 |
|---|---|
| Molecular Weight | 304.09 g/mol |
| LogP | -2.1 |
| Topological Polar Surface Area | 170.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 9 |
| Exact Mass | 304.09067 |
| Heavy Atoms | 21 |
| Complexity | 448.0 |
Chemical Identifiers
| CAS Number | 3106-85-2 |
|---|---|
| SMILES | CC(=O)NC(CC(=O)O)C(=O)NC(CCC(=O)O)C(=O)O |
| InChIKey | OPVPGKGADVGKTG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-Acetyl-alpha-aspartylglutamic acid (CAS 3106-85-2), with molecular formula C11H16N2O8 and molecular weight 304.09 g/mol. IUPAC: 2-[(2-acetamido-3-carboxypropanoyl)amino]pentanedioic acid.
Chemical Property Profile of N-Acetyl-alpha-aspartylglutamic acid
Property Insights of N-Acetyl-alpha-aspartylglutamic acid
The XLogP value of -2.1 indicates that N-Acetyl-alpha-aspartylglutamic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 170.0 Ų indicates high polarity, suggesting N-Acetyl-alpha-aspartylglutamic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N-Acetyl-alpha-aspartylglutamic acid has 5 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-Acetyl-alpha-aspartylglutamic acid?
The CAS number of N-Acetyl-alpha-aspartylglutamic acid is 3106-85-2.
What is the molecular formula of N-Acetyl-alpha-aspartylglutamic acid?
The molecular formula of N-Acetyl-alpha-aspartylglutamic acid is C11H16N2O8.
What is the molecular weight of N-Acetyl-alpha-aspartylglutamic acid?
The molecular weight of N-Acetyl-alpha-aspartylglutamic acid is 304.09 g/mol.
Where can I buy N-Acetyl-alpha-aspartylglutamic acid?
You can request a quote for N-Acetyl-alpha-aspartylglutamic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Acetyl-alpha-aspartylglutamic acid?
Yes, KEHONG BIO provides custom synthesis services for N-Acetyl-alpha-aspartylglutamic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.