Sophorose
TL;DR: Sophorose (CAS 534-46-3) is a chemical compound with molecular formula C12H22O11 and molecular weight 342.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R,3S,4R,5R)-3,4,5,6-tetrahydroxy-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyhexanal
Also Known As: Sophorose, alpha-Sophorose, Kojibiose, 2-O-beta-D-Glucopyranosyl-D-glucose, A-Galactobiose
| Molecular Formula | C12H22O11 |
|---|---|
| Molecular Weight | 342.12 g/mol |
| LogP | -5.0 |
| Topological Polar Surface Area | 197.0 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 8 |
| Exact Mass | 342.1162 |
| Heavy Atoms | 23 |
| Complexity | 367.0 |
Chemical Identifiers
| CAS Number | 534-46-3 |
|---|---|
| SMILES | C([C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)O[C@@H](C=O)[C@H]([C@@H]([C@@H](CO)O)O)O)O)O)O)O |
| InChIKey | PZDOWFGHCNHPQD-VNNZMYODSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Sophorose (CAS 534-46-3), with molecular formula C12H22O11 and molecular weight 342.12 g/mol. IUPAC: (2R,3S,4R,5R)-3,4,5,6-tetrahydroxy-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyhexanal.
Chemical Property Profile of Sophorose
Property Insights of Sophorose
The XLogP value of -5.0 indicates that Sophorose is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 197.0 Ų indicates high polarity, suggesting Sophorose may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Sophorose has 8 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Sophorose?
The CAS number of Sophorose is 534-46-3.
What is the molecular formula of Sophorose?
The molecular formula of Sophorose is C12H22O11.
What is the molecular weight of Sophorose?
The molecular weight of Sophorose is 342.12 g/mol.
Where can I buy Sophorose?
You can request a quote for Sophorose directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Sophorose?
Yes, KEHONG BIO provides custom synthesis services for Sophorose and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.