Abierixin
TL;DR: Abierixin (CAS 100634-16-0) is a chemical compound with molecular formula C40H68O11 and molecular weight 724.48 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-hydroxy-8-[2-[5-[5-[6-hydroxy-6-(hydroxymethyl)-3,5-dimethyloxan-2-yl]-3-methyloxolan-2-yl]-5-methyloxolan-2-yl]-7-methoxy-2,4,6-trimethyl-1,10-dioxaspiro[4.5]decan-9-yl]-2,4-dimethyloct-2-enoic acid
Also Known As: Abierixin
| Molecular Formula | C40H68O11 |
|---|---|
| Molecular Weight | 724.48 g/mol |
| LogP | 5.3 |
| Topological Polar Surface Area | 153.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 12 |
| Exact Mass | 724.47614 |
| Heavy Atoms | 51 |
| Complexity | 1240.0 |
Chemical Identifiers
| CAS Number | 100634-16-0 |
|---|---|
| SMILES | CC1CC(C(OC1C2CC(C(O2)C3(CCC(O3)C4(CC(C5(O4)C(C(CC(O5)CC(CCC(C)C=C(C)C(=O)O)O)OC)C)C)C)C)C)(CO)O)C |
| InChIKey | JQESXHYTUWEFCM-UHFFFAOYSA-N |
Product Overview
Abierixin (CAS 100634-16-0), with molecular formula C40H68O11 and molecular weight 724.48 g/mol. IUPAC: 7-hydroxy-8-[2-[5-[5-[6-hydroxy-6-(hydroxymethyl)-3,5-dimethyloxan-2-yl]-3-methyloxolan-2-yl]-5-methyloxolan-2-yl]-7-methoxy-2,4,6-trimethyl-1,10-dioxaspiro[4.5]decan-9-yl]-2,4-dimethyloct-2-enoic acid.
Chemical Property Profile of Abierixin
Property Insights of Abierixin
The XLogP value of 5.3 indicates that Abierixin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 153.0 Ų indicates high polarity, suggesting Abierixin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Abierixin 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 Abierixin?
The CAS number of Abierixin is 100634-16-0.
What is the molecular formula of Abierixin?
The molecular formula of Abierixin is C40H68O11.
What is the molecular weight of Abierixin?
The molecular weight of Abierixin is 724.48 g/mol.
Where can I buy Abierixin?
You can request a quote for Abierixin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Abierixin?
Yes, KEHONG BIO provides custom synthesis services for Abierixin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.