Polymyxin
TL;DR: Polymyxin (CAS 1406-11-7) is a chemical compound with molecular formula C48H82N16O14 and molecular weight 1106.62 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2S)-4-amino-1-[[(2S,3R)-1-[[(2S)-4-amino-1-oxo-1-[[(3S,6S,9S,12S,15R,18S,21S)-6,9,18-tris(2-aminoethyl)-15-benzyl-3-[(1R)-1-hydroxyethyl]-12-(2-methylpropyl)-2,5,8,11,14,17,20-heptaoxo-1,4,7,10,13,16,19-heptazacyclotricos-21-yl]amino]butan-2-yl]amino]-3-hydroxy-1-oxobutan-2-yl]amino]-1-oxobutan-2-yl]carbamic acid
Also Known As: Polymyxin, Polymyxinum, Polymyxins, Caswell No. 678, Polymyxin M
| Molecular Formula | C48H82N16O14 |
|---|---|
| Molecular Weight | 1106.62 g/mol |
| LogP | -7.6999 |
| Topological Polar Surface Area | 510.89 Ų |
| Hydrogen Bond Donors | 19 |
| Hydrogen Bond Acceptors | 18 |
| Rotatable Bonds | 23 |
| Exact Mass | 1106.6196 |
| Heavy Atoms | 78 |
| Complexity | 2173.247 |
Chemical Identifiers
| CAS Number | 1406-11-7 |
|---|---|
| SMILES | C[C@H]([C@H]1C(=O)NCC[C@@H](C(=O)N[C@H](C(=O)N[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1)CCN)CCN)CC(C)C)CC2=CC=CC=C2)CCN)NC(=O)[C@H](CCN)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](CCN)NC(=O)O)O |
Product Overview
Polymyxin (CAS 1406-11-7), with molecular formula C48H82N16O14 and molecular weight 1106.62 g/mol. IUPAC: [(2S)-4-amino-1-[[(2S,3R)-1-[[(2S)-4-amino-1-oxo-1-[[(3S,6S,9S,12S,15R,18S,21S)-6,9,18-tris(2-aminoethyl)-15-benzyl-3-[(1R)-1-hydroxyethyl]-12-(2-methylpropyl)-2,5,8,11,14,17,20-heptaoxo-1,4,7,10,13,16,19-heptazacyclotricos-21-yl]amino]butan-2-yl]amino]-3-hydroxy-1-oxobutan-2-yl]amino]-1-oxobutan-2-yl]carbamic acid.
Chemical Property Profile of Polymyxin
Property Insights of Polymyxin
The XLogP value of -7.6999 indicates that Polymyxin is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 510.89 Ų indicates high polarity, suggesting Polymyxin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Polymyxin has 19 hydrogen bond donor(s) and 18 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Polymyxin?
The CAS number of Polymyxin is 1406-11-7.
What is the molecular formula of Polymyxin?
The molecular formula of Polymyxin is C48H82N16O14.
What is the molecular weight of Polymyxin?
The molecular weight of Polymyxin is 1106.62 g/mol.
Where can I buy Polymyxin?
You can request a quote for Polymyxin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Polymyxin?
Yes, KEHONG BIO provides custom synthesis services for Polymyxin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.