赛拉菌素
TL;DR: 赛拉菌素 (CAS 220119-17-5) is a chemical compound with molecular formula C43H63NO11 and molecular weight 769.44 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
赛拉菌素
(1R,4S,5'S,6R,6'S,8R,12S,13S,20R,21E,24S)-6'-cyclohexyl-24-hydroxy-21-hydroxyimino-12-[(2R,4S,5S,6S)-5-hydroxy-4-methoxy-6-methyloxan-2-yl]oxy-5',11,13,22-tetramethylspiro[3,7,19-trioxatetracyclo[15.6.1.14,8.020,24]pentacosa-10,14,16,22-tetraene-6,2'-oxane]-2-one
Also Known As: selamectin
| Molecular Formula | C43H63NO11 |
|---|---|
| Molecular Weight | 769.44 g/mol |
| LogP | 6.0698 |
| Topological Polar Surface Area | 154.73 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 4 |
| Exact Mass | 769.4401 |
| Heavy Atoms | 55 |
| Complexity | 1549.9521 |
Chemical Identifiers
| CAS Number | 220119-17-5 |
|---|---|
| SMILES | C[C@H]1CC[C@]2(C[C@@H]3C[C@H](O2)CC=C([C@H]([C@H](C=CC=C4CO[C@H]\5[C@@]4([C@@H](C=C(/C5=N\O)C)C(=O)O3)O)C)O[C@H]6C[C@@H]([C@H]([C@@H](O6)C)O)OC)C)O[C@@H]1C7CCCCC7 |
Product Overview
赛拉菌素 (CAS 220119-17-5), with molecular formula C43H63NO11 and molecular weight 769.44 g/mol. IUPAC: (1R,4S,5'S,6R,6'S,8R,12S,13S,20R,21E,24S)-6'-cyclohexyl-24-hydroxy-21-hydroxyimino-12-[(2R,4S,5S,6S)-5-hydroxy-4-methoxy-6-methyloxan-2-yl]oxy-5',11,13,22-tetramethylspiro[3,7,19-trioxatetracyclo[15.6.1.14,8.020,24]pentacosa-10,14,16,22-tetraene-6,2'-oxane]-2-one.
Chemical Property Profile of 赛拉菌素
Property Insights of 赛拉菌素
The XLogP value of 6.0698 indicates that 赛拉菌素 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 154.73 Ų indicates high polarity, suggesting 赛拉菌素 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 赛拉菌素 has 3 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 赛拉菌素?
The CAS number of 赛拉菌素 is 220119-17-5.
What is the molecular formula of 赛拉菌素?
The molecular formula of 赛拉菌素 is C43H63NO11.
What is the molecular weight of 赛拉菌素?
The molecular weight of 赛拉菌素 is 769.44 g/mol.
Where can I buy 赛拉菌素?
You can request a quote for 赛拉菌素 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 赛拉菌素?
Yes, KEHONG BIO provides custom synthesis services for 赛拉菌素 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.