TL;DR: Abierixin (CAS 100634-16-0) is a chemical compound with molecular formula C40H68O11 and molecular weight 724.47614 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
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 | 724.47614 g/mol |
| XLogP | 5.3 |
| Topological Polar Surface Area (TPSA) | 153.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 12 |
| Exact Mass | 724.47614 Da |
| Heavy Atoms | 51 |
| Complexity | 1240.0 |
| 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 |
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.
The CAS number of Abierixin is 100634-16-0.
The molecular formula of Abierixin is C40H68O11.
The molecular weight of Abierixin is 724.47614 g/mol.
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