TL;DR: Gnetulin (CAS 152340-24-4) is a chemical compound with molecular formula C30H26O8 and molecular weight 514.1628 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(1Z,2S,3S)-2-(3,5-dihydroxyphenyl)-3-(4-hydroxy-3-methoxyphenyl)-1-[(4-hydroxy-3-methoxyphenyl)methylidene]-2,3-dihydroindene-4,6-diol
Also Known As: Gnetulin, (1Z,2S,3S)-2-(3,5-dihydroxyphenyl)-3-(4-hydroxy-3-methoxyphenyl)-1-[(4-hydroxy-3-methoxyphenyl)methylidene]-2,3-dihydroindene-4,6-diol
| Molecular Formula | C30H26O8 |
| Molecular Weight | 514.1628 g/mol |
| XLogP | 4.8 |
| Topological Polar Surface Area (TPSA) | 140.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 514.1628 Da |
| Heavy Atoms | 38 |
| Complexity | 810.0 |
| SMILES | COC1=C(C=CC(=C1)/C=C\2/[C@@H]([C@H](C3=C2C=C(C=C3O)O)C4=CC(=C(C=C4)O)OC)C5=CC(=CC(=C5)O)O)O |
| InChIKey | YUGHGAXRXHODHK-VEJRHNPISA-N |
The XLogP value of 4.8 indicates that Gnetulin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 140.0 Ų indicates high polarity, suggesting Gnetulin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Gnetulin has 6 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Gnetulin is 152340-24-4.
The molecular formula of Gnetulin is C30H26O8.
The molecular weight of Gnetulin is 514.1628 g/mol.
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