TL;DR: Dihydrosterigmatin (CAS 101489-26-3) is a chemical compound with molecular formula C17H12O6 and molecular weight 312.0634 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(4S,8R)-2,18-dihydroxy-7,9,13-trioxapentacyclo[10.8.0.03,10.04,8.014,19]icosa-1,3(10),11,14,16,18-hexaen-20-one
Also Known As: Dihydrosterigmatin, 4,6-dihydroxy-2,3,3a,12a-tetrahydrofuro[2,3-b]furoxanth-5-one, (3aS,12aR)-4,6-Dihydroxy-2,3,3a,12a-tetrahydro-5H-furo[3',2':4,5]furo[3,2-b]xanthen-5-one, CCRIS 3224
| Molecular Formula | C17H12O6 |
| Molecular Weight | 312.0634 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 85.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 0 |
| Exact Mass | 312.0634 Da |
| Heavy Atoms | 23 |
| Complexity | 509.0 |
| SMILES | C1CO[C@H]2[C@@H]1C3=C(O2)C=C4C(=C3O)C(=O)C5=C(C=CC=C5O4)O |
| InChIKey | PRRQIVLVKMGUEC-BWKAKNAASA-N |
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dihydrosterigmatin. The TPSA of 85.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Dihydrosterigmatin. Following Lipinski's Rule of Five, Dihydrosterigmatin 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 Dihydrosterigmatin is 101489-26-3.
The molecular formula of Dihydrosterigmatin is C17H12O6.
The molecular weight of Dihydrosterigmatin is 312.0634 g/mol.
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