TL;DR: (2S,3R)-2-(3,4-dihydroxyphenyl)-3,7-dihydroxy-2,3-dihydrochromen-4-one (CAS 20725-03-5) is a chemical compound with molecular formula C15H12O6 and molecular weight 288.0634 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S,3R)-2-(3,4-dihydroxyphenyl)-3,7-dihydroxy-2,3-dihydrochromen-4-one
Also Known As: Dihydrofisetin, Fustin, Tetrahydroxyflavanone, 2,3-Dihydrofisetin, KST-1A2665
| Molecular Formula | C15H12O6 |
| Molecular Weight | 288.0634 g/mol |
| XLogP | 1.3 |
| Topological Polar Surface Area (TPSA) | 107.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 288.0634 Da |
| Heavy Atoms | 21 |
| Complexity | 400.0 |
| SMILES | C1=CC(=C(C=C1[C@H]2[C@H](C(=O)C3=C(O2)C=C(C=C3)O)O)O)O |
| InChIKey | FNUPUYFWZXZMIE-GJZGRUSLSA-N |
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2S,3R)-2-(3,4-dihydroxyphenyl)-3,7-dihydroxy-2,3-dihydrochromen-4-one. The TPSA of 107.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (2S,3R)-2-(3,4-dihydroxyphenyl)-3,7-dihydroxy-2,3-dihydrochromen-4-one. Following Lipinski's Rule of Five, (2S,3R)-2-(3,4-dihydroxyphenyl)-3,7-dihydroxy-2,3-dihydrochromen-4-one has 4 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of (2S,3R)-2-(3,4-dihydroxyphenyl)-3,7-dihydroxy-2,3-dihydrochromen-4-one is 20725-03-5.
The molecular formula of (2S,3R)-2-(3,4-dihydroxyphenyl)-3,7-dihydroxy-2,3-dihydrochromen-4-one is C15H12O6.
The molecular weight of (2S,3R)-2-(3,4-dihydroxyphenyl)-3,7-dihydroxy-2,3-dihydrochromen-4-one is 288.0634 g/mol.
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