TL;DR: Afzelechin-(4alpha-->8)-epiafzelechin (CAS 1383627-30-2) is a chemical compound with molecular formula C30H26O10 and molecular weight 546.1526 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(4-hydroxyphenyl)-8-[3,5,7-trihydroxy-2-(4-hydroxyphenyl)-3,4-dihydro-2H-chromen-4-yl]-3,4-dihydro-2H-chromene-3,5,7-triol
Also Known As: Afzelechin-(4alpha-->8)-epiafzelechin, Afzelechin-(4a8)-epiafzelechin, Afzelechin-(4??8)-epiafzelechin, Afzelechin-(4, A inverted exclamation marku8)-epiafzelechin
| Molecular Formula | C30H26O10 |
| Molecular Weight | 546.1526 g/mol |
| XLogP | 3.1 |
| Topological Polar Surface Area (TPSA) | 180.0 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 3 |
| Exact Mass | 546.1526 Da |
| Heavy Atoms | 40 |
| Complexity | 844.0 |
| SMILES | C1C(C(OC2=C1C(=CC(=C2C3C(C(OC4=CC(=CC(=C34)O)O)C5=CC=C(C=C5)O)O)O)O)C6=CC=C(C=C6)O)O |
| InChIKey | JESPWQGCCOLVKQ-UHFFFAOYSA-N |
The XLogP value of 3.1 indicates that Afzelechin-(4alpha-->8)-epiafzelechin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 180.0 Ų indicates high polarity, suggesting Afzelechin-(4alpha-->8)-epiafzelechin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Afzelechin-(4alpha-->8)-epiafzelechin has 8 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Afzelechin-(4alpha-->8)-epiafzelechin is 1383627-30-2.
The molecular formula of Afzelechin-(4alpha-->8)-epiafzelechin is C30H26O10.
The molecular weight of Afzelechin-(4alpha-->8)-epiafzelechin is 546.1526 g/mol.
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