Glucoiberverin
TL;DR: Glucoiberverin (CAS 26888-03-9) is a chemical compound with molecular formula C11H21NO9S3 and molecular weight 407.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] 4-methylsulfanyl-N-sulfooxybutanimidothioate
Also Known As: Glucoiberverin, GLUCOIBERVIRIN, 3-Methylthiopropyl glucosinolate, omega-(Methylthio)alkyl-glucosinolate, Glucoiberverin (3-Methylthiopropyl-GS)
| Molecular Formula | C11H21NO9S3 |
|---|---|
| Molecular Weight | 407.04 g/mol |
| LogP | -0.9 |
| Topological Polar Surface Area | 225.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 9 |
| Exact Mass | 407.03784 |
| Heavy Atoms | 24 |
| Complexity | 509.0 |
Chemical Identifiers
| CAS Number | 26888-03-9 |
|---|---|
| SMILES | CSCCCC(=NOS(=O)(=O)O)S[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O |
| InChIKey | ZCZCVJVUJGULMO-ZHVGPZTNSA-N |
Product Overview
Glucoiberverin (CAS 26888-03-9), with molecular formula C11H21NO9S3 and molecular weight 407.04 g/mol. IUPAC: [(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] 4-methylsulfanyl-N-sulfooxybutanimidothioate.
Chemical Property Profile of Glucoiberverin
Property Insights of Glucoiberverin
The XLogP value of -0.9 indicates that Glucoiberverin is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 225.0 Ų indicates high polarity, suggesting Glucoiberverin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Glucoiberverin has 5 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Glucoiberverin?
The CAS number of Glucoiberverin is 26888-03-9.
What is the molecular formula of Glucoiberverin?
The molecular formula of Glucoiberverin is C11H21NO9S3.
What is the molecular weight of Glucoiberverin?
The molecular weight of Glucoiberverin is 407.04 g/mol.
Where can I buy Glucoiberverin?
You can request a quote for Glucoiberverin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Glucoiberverin?
Yes, KEHONG BIO provides custom synthesis services for Glucoiberverin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.