A28086B
TL;DR: A28086B (CAS 6966-91-2) is a chemical compound with molecular formula C43H70O11 and molecular weight 762.49 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[6-[6-[3-(5-ethyl-5-hydroxy-6-methyloxan-2-yl)-3,10,12-trimethyl-15-oxo-4,6,8-trioxadispiro[4.1.57.35]pentadec-13-en-9-yl]-3-hydroxy-4-methyl-5-oxooctan-2-yl]-3,5-dimethyloxan-2-yl]butanoic acid
Also Known As: Narasin B, Antibiotic A 28086B, A 28086B, (4S)-20-Deoxy-20-oxo-4beta-methylsalinomycin, A-28086 B
| Molecular Formula | C43H70O11 |
|---|---|
| Molecular Weight | 762.49 g/mol |
| LogP | 6.5 |
| Topological Polar Surface Area | 158.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 12 |
| Exact Mass | 762.4918 |
| Heavy Atoms | 54 |
| Complexity | 1400.0 |
Chemical Identifiers
| CAS Number | 6966-91-2 |
|---|---|
| SMILES | CCC(C1C(CC(C(O1)C(C)C(C(C)C(=O)C(CC)C2C(CC(C3(O2)C=CC(=O)C4(O3)CCC(O4)(C)C5CCC(C(O5)C)(CC)O)C)C)O)C)C)C(=O)O |
| InChIKey | FBLJTCGAXDPRJH-UHFFFAOYSA-N |
Product Overview
A28086B (CAS 6966-91-2), with molecular formula C43H70O11 and molecular weight 762.49 g/mol. IUPAC: 2-[6-[6-[3-(5-ethyl-5-hydroxy-6-methyloxan-2-yl)-3,10,12-trimethyl-15-oxo-4,6,8-trioxadispiro[4.1.57.35]pentadec-13-en-9-yl]-3-hydroxy-4-methyl-5-oxooctan-2-yl]-3,5-dimethyloxan-2-yl]butanoic acid.
Chemical Property Profile of A28086B
Property Insights of A28086B
The XLogP value of 6.5 indicates that A28086B is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 158.0 Ų indicates high polarity, suggesting A28086B may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, A28086B has 3 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 A28086B?
The CAS number of A28086B is 6966-91-2.
What is the molecular formula of A28086B?
The molecular formula of A28086B is C43H70O11.
What is the molecular weight of A28086B?
The molecular weight of A28086B is 762.49 g/mol.
Where can I buy A28086B?
You can request a quote for A28086B directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A28086B?
Yes, KEHONG BIO provides custom synthesis services for A28086B and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.