Polyoxin A
TL;DR: Polyoxin A (CAS 19396-03-3) is a chemical compound with molecular formula C23H32N6O14 and molecular weight 616.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,3Z)-1-[(2S)-2-[[(2S,3S,4S)-2-amino-5-carbamoyloxy-3,4-dihydroxypentanoyl]amino]-2-[(2R,3S,4R,5R)-3,4-dihydroxy-5-[5-(hydroxymethyl)-2,4-dioxopyrimidin-1-yl]oxolan-2-yl]acetyl]-3-ethylideneazetidine-2-carboxylic acid
Also Known As: Polyoxin A, POLYOXIN A [MI], (2S,3Z)-1-[(2S)-2-[[(2S,3S,4S)-2-amino-5-carbamoyloxy-3,4-dihydroxypentanoyl]amino]-2-[(2R,3S,4R,5R)-3,4-dihydroxy-5-[5-(hydroxymethyl)-2,4-dioxopyrimidin-1-yl]oxolan-2-yl]acetyl]-3-ethylideneazetidine-2-carboxylic acid, (S-(E))-1-(5-((2-Amino-5-O-(aminocarbonyl)-2-deoxy-L-xylonoyl)amino)-1,5-dideoxy-1-(3,4-dihydro-5-(hydroxymethyl)-2,4-dioxo-1(2H)-pyrimidinyl)-beta-D-allofuranuronoyl)-3-ethylidene-2- azetidinecarboxylic acid, 2-Azetidinecarboxylic acid, 1-(5-(2-amino-2-deoxy-L-xylonamido)-1,5-dideoxy-1-(3,4-dihydro-5-(hydroxymethyl)-2,4-dioxo-1(2H)-pyrimidinyl)-beta-D-allofuranuronoyl)-3-ethylidene-, monocarbamate (ester), (E)-L-
| Molecular Formula | C23H32N6O14 |
|---|---|
| Molecular Weight | 616.20 g/mol |
| LogP | -6.481 |
| Topological Polar Surface Area | 330.29 Ų |
| Hydrogen Bond Donors | 10 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 11 |
| Exact Mass | 616.19763 |
| Heavy Atoms | 43 |
| Complexity | 1392.956 |
Chemical Identifiers
| CAS Number | 19396-03-3 |
|---|---|
| SMILES | C/C=C\1/CN([C@@H]1C(=O)O)C(=O)[C@H]([C@@H]2[C@H]([C@H]([C@@H](O2)N3C=C(C(=O)NC3=O)CO)O)O)NC(=O)[C@H]([C@@H]([C@H](COC(=O)N)O)O)N |
Product Overview
Polyoxin A (CAS 19396-03-3), with molecular formula C23H32N6O14 and molecular weight 616.20 g/mol. IUPAC: (2S,3Z)-1-[(2S)-2-[[(2S,3S,4S)-2-amino-5-carbamoyloxy-3,4-dihydroxypentanoyl]amino]-2-[(2R,3S,4R,5R)-3,4-dihydroxy-5-[5-(hydroxymethyl)-2,4-dioxopyrimidin-1-yl]oxolan-2-yl]acetyl]-3-ethylideneazetidine-2-carboxylic acid.
Chemical Property Profile of Polyoxin A
Property Insights of Polyoxin A
The XLogP value of -6.481 indicates that Polyoxin A is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 330.29 Ų indicates high polarity, suggesting Polyoxin A may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Polyoxin A has 10 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Polyoxin A?
The CAS number of Polyoxin A is 19396-03-3.
What is the molecular formula of Polyoxin A?
The molecular formula of Polyoxin A is C23H32N6O14.
What is the molecular weight of Polyoxin A?
The molecular weight of Polyoxin A is 616.20 g/mol.
Where can I buy Polyoxin A?
You can request a quote for Polyoxin A directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Polyoxin A?
Yes, KEHONG BIO provides custom synthesis services for Polyoxin A and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.