1-0-(L-beta-Aspartyl)-beta-D-glucopyranose
TL;DR: 1-0-(L-beta-Aspartyl)-beta-D-glucopyranose (CAS 5423-16-5) is a chemical compound with molecular formula C10H17NO9 and molecular weight 295.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-amino-4-oxo-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutanoic acid
Also Known As: Sid 768603, KST-1A5673, L-Aspartic acid, 4-beta-D-glucopyranosyl ester, 1-0-(L-beta-Aspartyl)-beta-D-glucopyranose, (2S)-2-amino-4-oxo-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutanoic acid
| Molecular Formula | C10H17NO9 |
|---|---|
| Molecular Weight | 295.09 g/mol |
| LogP | -5.7 |
| Topological Polar Surface Area | 180.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 6 |
| Exact Mass | 295.09033 |
| Heavy Atoms | 20 |
| Complexity | 363.0 |
Chemical Identifiers
| CAS Number | 5423-16-5 |
|---|---|
| SMILES | C([C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)OC(=O)C[C@@H](C(=O)O)N)O)O)O)O |
| InChIKey | UOZGZMFRMIEFIX-RFSIWRIWSA-N |
Product Overview
1-0-(L-beta-Aspartyl)-beta-D-glucopyranose (CAS 5423-16-5), with molecular formula C10H17NO9 and molecular weight 295.09 g/mol. IUPAC: (2S)-2-amino-4-oxo-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutanoic acid.
Chemical Property Profile of 1-0-(L-beta-Aspartyl)-beta-D-glucopyranose
Property Insights of 1-0-(L-beta-Aspartyl)-beta-D-glucopyranose
The XLogP value of -5.7 indicates that 1-0-(L-beta-Aspartyl)-beta-D-glucopyranose is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 180.0 Ų indicates high polarity, suggesting 1-0-(L-beta-Aspartyl)-beta-D-glucopyranose may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1-0-(L-beta-Aspartyl)-beta-D-glucopyranose 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 1-0-(L-beta-Aspartyl)-beta-D-glucopyranose?
The CAS number of 1-0-(L-beta-Aspartyl)-beta-D-glucopyranose is 5423-16-5.
What is the molecular formula of 1-0-(L-beta-Aspartyl)-beta-D-glucopyranose?
The molecular formula of 1-0-(L-beta-Aspartyl)-beta-D-glucopyranose is C10H17NO9.
What is the molecular weight of 1-0-(L-beta-Aspartyl)-beta-D-glucopyranose?
The molecular weight of 1-0-(L-beta-Aspartyl)-beta-D-glucopyranose is 295.09 g/mol.
Where can I buy 1-0-(L-beta-Aspartyl)-beta-D-glucopyranose?
You can request a quote for 1-0-(L-beta-Aspartyl)-beta-D-glucopyranose directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-0-(L-beta-Aspartyl)-beta-D-glucopyranose?
Yes, KEHONG BIO provides custom synthesis services for 1-0-(L-beta-Aspartyl)-beta-D-glucopyranose and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.