TL;DR: Antafumicin A (CAS 151271-54-4) is a chemical compound with molecular formula C13H14O6 and molecular weight 266.07904 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3R,5S)-5-(3-acetyl-2,6-dihydroxyphenyl)-3-methoxyoxolan-2-one
Also Known As: Antafumicin A, Antafumicin B, (3R,5S)-5-(3-acetyl-2,6-dihydroxyphenyl)-3-methoxyoxolan-2-one, 4-(3-Acetyl-2,6-dihydroxyphenyl)-2-methoxy-4-butanolide, 5-(3-acetyl-2,6-dihydroxyphenyl)-3-methoxyoxolan-2-one
| Molecular Formula | C13H14O6 |
| Molecular Weight | 266.07904 g/mol |
| XLogP | 1.2 |
| Topological Polar Surface Area (TPSA) | 93.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 266.07904 Da |
| Heavy Atoms | 19 |
| Complexity | 368.0 |
| SMILES | CC(=O)C1=C(C(=C(C=C1)O)[C@@H]2C[C@H](C(=O)O2)OC)O |
| InChIKey | FTMZAUPTWYKXKM-VHSXEESVSA-N |
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Antafumicin A. The TPSA of 93.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Antafumicin A. Following Lipinski's Rule of Five, Antafumicin A has 2 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 Antafumicin A is 151271-54-4.
The molecular formula of Antafumicin A is C13H14O6.
The molecular weight of Antafumicin A is 266.07904 g/mol.
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