放线硫醇
TL;DR: 放线硫醇 (CAS 192126-76-4) is a chemical compound with molecular formula C17H30N2O12S and molecular weight 486.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
放线硫醇
2-acetamido-N-[4,5-dihydroxy-6-(hydroxymethyl)-2-(2,3,4,5,6-pentahydroxycyclohexyl)oxyoxan-3-yl]-3-sulfanylpropanamide
Also Known As: mycothiol, 2-acetamido-N-[4,5-dihydroxy-6-(hydroxymethyl)-2-(2,3,4,5,6-pentahydroxycyclohexyl)oxyoxan-3-yl]-3-sulfanylpropanamide
| Molecular Formula | C17H30N2O12S |
|---|---|
| Molecular Weight | 486.15 g/mol |
| LogP | -5.6 |
| Topological Polar Surface Area | 240.0 Ų |
| Hydrogen Bond Donors | 11 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 7 |
| Exact Mass | 486.15195 |
| Heavy Atoms | 32 |
| Complexity | 643.0 |
Chemical Identifiers
| CAS Number | 192126-76-4 |
|---|---|
| SMILES | CC(=O)NC(CS)C(=O)NC1C(C(C(OC1OC2C(C(C(C(C2O)O)O)O)O)CO)O)O |
| InChIKey | MQBCDKMPXVYCGO-UHFFFAOYSA-N |
Product Overview
放线硫醇 (CAS 192126-76-4), with molecular formula C17H30N2O12S and molecular weight 486.15 g/mol. IUPAC: 2-acetamido-N-[4,5-dihydroxy-6-(hydroxymethyl)-2-(2,3,4,5,6-pentahydroxycyclohexyl)oxyoxan-3-yl]-3-sulfanylpropanamide.
Chemical Property Profile of 放线硫醇
Property Insights of 放线硫醇
The XLogP value of -5.6 indicates that 放线硫醇 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 240.0 Ų indicates high polarity, suggesting 放线硫醇 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 放线硫醇 has 11 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 放线硫醇?
The CAS number of 放线硫醇 is 192126-76-4.
What is the molecular formula of 放线硫醇?
The molecular formula of 放线硫醇 is C17H30N2O12S.
What is the molecular weight of 放线硫醇?
The molecular weight of 放线硫醇 is 486.15 g/mol.
Where can I buy 放线硫醇?
You can request a quote for 放线硫醇 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 放线硫醇?
Yes, KEHONG BIO provides custom synthesis services for 放线硫醇 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.