Asbestinin 1
TL;DR: Asbestinin 1 (CAS 74219-41-3) is a chemical compound with molecular formula C26H40O6 and molecular weight 448.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(14Z)-12-acetyloxy-5,8,11,15-tetramethyl-10,18-dioxatetracyclo[9.7.0.02,7.03,17]octadec-14-en-4-yl] butanoate
Also Known As: Asbestinin 1, Asbestinin 2, Butanoic acid, 10-(acetyloxy)-2a,3,4,5,5a,6,7,9,9a,9b-decahydro-4,6,9,13-tetramethyl-2,9-(2)pentano-2H-furo(2,3,4-ef)(3)benzoxepin-3-yl ester, (2R*,2aS*,3S*,4S*,5aR*,6S*,9R*,9aR*,9bR*,10S*,12Z)-(-)-
| Molecular Formula | C26H40O6 |
|---|---|
| Molecular Weight | 448.28 g/mol |
| LogP | 4.4509 |
| Topological Polar Surface Area | 71.06 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 448.2825 |
| Heavy Atoms | 32 |
| Complexity | 761.4161 |
Chemical Identifiers
| CAS Number | 74219-41-3 |
|---|---|
| SMILES | CCCC(=O)OC1C(CC2C(COC3(C(C/C=C(\CC4C1C2C3O4)/C)OC(=O)C)C)C)C |
Product Overview
Asbestinin 1 (CAS 74219-41-3), with molecular formula C26H40O6 and molecular weight 448.28 g/mol. IUPAC: [(14Z)-12-acetyloxy-5,8,11,15-tetramethyl-10,18-dioxatetracyclo[9.7.0.02,7.03,17]octadec-14-en-4-yl] butanoate.
Chemical Property Profile of Asbestinin 1
Property Insights of Asbestinin 1
The XLogP value of 4.4509 indicates that Asbestinin 1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.06 Ų falls within the moderate polarity range, balancing permeability and solubility for Asbestinin 1. Following Lipinski's Rule of Five, Asbestinin 1 has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Asbestinin 1?
The CAS number of Asbestinin 1 is 74219-41-3.
What is the molecular formula of Asbestinin 1?
The molecular formula of Asbestinin 1 is C26H40O6.
What is the molecular weight of Asbestinin 1?
The molecular weight of Asbestinin 1 is 448.28 g/mol.
Where can I buy Asbestinin 1?
You can request a quote for Asbestinin 1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Asbestinin 1?
Yes, KEHONG BIO provides custom synthesis services for Asbestinin 1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.