Virginiamycin S1
TL;DR: Virginiamycin S1 (CAS 23152-29-6) is a chemical compound with molecular formula C43H49N7O10 and molecular weight 823.35 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-benzyl-12-ethyl-4,16-dimethyl-2,5,11,14,18,21,24-heptaoxo-19-phenyl-17-oxa-1,4,10,13,20-pentazatricyclo[20.4.0.06,10]hexacosan-15-yl)-3-hydroxypyridine-2-carboxamide
Also Known As: Virginiamycin S1, Virginiamycin, Staphylomycin S, Staphylomycin S1, Virginiamycin factor S
| Molecular Formula | C43H49N7O10 |
|---|---|
| Molecular Weight | 823.35 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 225.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 6 |
| Exact Mass | 823.35406 |
| Heavy Atoms | 60 |
| Complexity | 1620.0 |
Chemical Identifiers
| CAS Number | 23152-29-6 |
|---|---|
| SMILES | CCC1C(=O)N2CCCC2C(=O)N(C(C(=O)N3CCC(=O)CC3C(=O)NC(C(=O)OC(C(C(=O)N1)NC(=O)C4=C(C=CC=N4)O)C)C5=CC=CC=C5)CC6=CC=CC=C6)C |
| InChIKey | FEPMHVLSLDOMQC-UHFFFAOYSA-N |
Product Overview
Virginiamycin S1 (CAS 23152-29-6), with molecular formula C43H49N7O10 and molecular weight 823.35 g/mol. IUPAC: N-(3-benzyl-12-ethyl-4,16-dimethyl-2,5,11,14,18,21,24-heptaoxo-19-phenyl-17-oxa-1,4,10,13,20-pentazatricyclo[20.4.0.06,10]hexacosan-15-yl)-3-hydroxypyridine-2-carboxamide.
Chemical Property Profile of Virginiamycin S1
Property Insights of Virginiamycin S1
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Virginiamycin S1. The TPSA of 225.0 Ų indicates high polarity, suggesting Virginiamycin S1 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Virginiamycin S1 has 4 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Virginiamycin S1?
The CAS number of Virginiamycin S1 is 23152-29-6.
What is the molecular formula of Virginiamycin S1?
The molecular formula of Virginiamycin S1 is C43H49N7O10.
What is the molecular weight of Virginiamycin S1?
The molecular weight of Virginiamycin S1 is 823.35 g/mol.
Where can I buy Virginiamycin S1?
You can request a quote for Virginiamycin S1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Virginiamycin S1?
Yes, KEHONG BIO provides custom synthesis services for Virginiamycin S1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.