Toxin Ii (helminthosporium Carbonum)
TL;DR: Toxin Ii (helminthosporium Carbonum) (CAS 106973-32-4) is a chemical compound with molecular formula C20H30N4O6 and molecular weight 422.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-methyl-3-[6-(oxiran-2-yl)-6-oxohexyl]-1,4,7,10-tetrazabicyclo[10.3.0]pentadecane-2,5,8,11-tetrone
Also Known As: HC-toxin-II, Toxin Ii (helminthosporium Carbonum), Cyclo(alanylglycyl-8-oxiranyl-8-oxo-2-aminooctanoylprolyl), Cyclo(alanylglycyl-a-amino-h-oxooxiraneoctanoylprolyl) (9CI), 9-methyl-3-[6-(oxiran-2-yl)-6-oxohexyl]-1,4,7,10-tetrazabicyclo[10.3.0]pentadecane-2,5,8,11-tetrone
| Molecular Formula | C20H30N4O6 |
|---|---|
| Molecular Weight | 422.22 g/mol |
| LogP | -0.5 |
| Topological Polar Surface Area | 137.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 422.21652 |
| Heavy Atoms | 30 |
| Complexity | 711.0 |
Chemical Identifiers
| CAS Number | 106973-32-4 |
|---|---|
| SMILES | CC1C(=O)NCC(=O)NC(C(=O)N2CCCC2C(=O)N1)CCCCCC(=O)C3CO3 |
| InChIKey | QFOXNKUWRWEOQL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Toxin Ii (helminthosporium Carbonum) (CAS 106973-32-4), with molecular formula C20H30N4O6 and molecular weight 422.22 g/mol. IUPAC: 9-methyl-3-[6-(oxiran-2-yl)-6-oxohexyl]-1,4,7,10-tetrazabicyclo[10.3.0]pentadecane-2,5,8,11-tetrone.
Chemical Property Profile of Toxin Ii (helminthosporium Carbonum)
Property Insights of Toxin Ii (helminthosporium Carbonum)
The XLogP value of -0.5 indicates that Toxin Ii (helminthosporium Carbonum) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 137.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Toxin Ii (helminthosporium Carbonum). Following Lipinski's Rule of Five, Toxin Ii (helminthosporium Carbonum) has 3 hydrogen bond donor(s) and 6 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 Toxin Ii (helminthosporium Carbonum)?
The CAS number of Toxin Ii (helminthosporium Carbonum) is 106973-32-4.
What is the molecular formula of Toxin Ii (helminthosporium Carbonum)?
The molecular formula of Toxin Ii (helminthosporium Carbonum) is C20H30N4O6.
What is the molecular weight of Toxin Ii (helminthosporium Carbonum)?
The molecular weight of Toxin Ii (helminthosporium Carbonum) is 422.22 g/mol.
Where can I buy Toxin Ii (helminthosporium Carbonum)?
You can request a quote for Toxin Ii (helminthosporium Carbonum) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Toxin Ii (helminthosporium Carbonum)?
Yes, KEHONG BIO provides custom synthesis services for Toxin Ii (helminthosporium Carbonum) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.