Turgorin
TL;DR: Turgorin (CAS 80220-30-0) is a chemical compound with molecular formula C13H15O13S- and molecular weight 411.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2R,3S,4S,5R,6S)-6-(4-carboxy-2,6-dihydroxyphenoxy)-3,4,5-trihydroxyoxan-2-yl]methyl sulfate
Also Known As: Turgorin, [(2R,3S,4S,5R,6S)-6-(4-carboxy-2,6-dihydroxyphenoxy)-3,4,5-trihydroxyoxan-2-yl]methyl sulfate, 4-Carboxy-2,6-dihydroxyphenyl 6-O-sulfonato-beta-D-glucopyranoside, [(2R,3S,4S,5R,6S)-6-(4-carboxy-2,6-dihydroxy-phenoxy)-3,4,5-trihydroxy-tetrahydropyran-2-yl]methyl sulfate, ((2R,3S,4S,5R,6S)-6-(4-carboxy-2,6-dihydroxy-phenoxy)-3,4,5-trihydroxy-tetrahydropyran-2-yl)methyl sulfate
| Molecular Formula | C13H15O13S- |
|---|---|
| Molecular Weight | 411.02 g/mol |
| LogP | -2.4 |
| Topological Polar Surface Area | 232.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 5 |
| Exact Mass | 411.02335 |
| Heavy Atoms | 27 |
| Complexity | 593.0 |
Chemical Identifiers
| CAS Number | 80220-30-0 |
|---|---|
| SMILES | C1=C(C=C(C(=C1O)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)COS(=O)(=O)[O-])O)O)O)O)C(=O)O |
| InChIKey | PCNPDUJUHNLVNS-YANYRWCTSA-M |
Product Overview
Turgorin (CAS 80220-30-0), with molecular formula C13H15O13S- and molecular weight 411.02 g/mol. IUPAC: [(2R,3S,4S,5R,6S)-6-(4-carboxy-2,6-dihydroxyphenoxy)-3,4,5-trihydroxyoxan-2-yl]methyl sulfate.
Chemical Property Profile of Turgorin
Property Insights of Turgorin
The XLogP value of -2.4 indicates that Turgorin is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 232.0 Ų indicates high polarity, suggesting Turgorin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Turgorin has 6 hydrogen bond donor(s) and 13 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Turgorin?
The CAS number of Turgorin is 80220-30-0.
What is the molecular formula of Turgorin?
The molecular formula of Turgorin is C13H15O13S-.
What is the molecular weight of Turgorin?
The molecular weight of Turgorin is 411.02 g/mol.
Where can I buy Turgorin?
You can request a quote for Turgorin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Turgorin?
Yes, KEHONG BIO provides custom synthesis services for Turgorin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.