TL;DR: Cyclopenta(c)furo(3',2':4,5)furo(2,3-h)(1)benzopyran-1,11-dione, 2,3,6a,9a-tetrahydro-4,9a-dihydroxy-, (6aR-cis)- (CAS 113568-92-6) is a chemical compound with molecular formula C16H10O7 and molecular weight 314.04266 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3R,7R)-3,11-dihydroxy-6,8,19-trioxapentacyclo[10.7.0.02,9.03,7.013,17]nonadeca-1(12),2(9),4,10,13(17)-pentaene-16,18-dione
Also Known As: Cyclopenta(c)furo(3',2':4,5)furo(2,3-h)(1)benzopyran-1,11-dione, 2,3,6a,9a-tetrahydro-4,9a-dihydroxy-, (6aR-cis)-, (6aR,9aR)-4,9a-Dihydroxy-2,3,6a,9a-tetrahydrocyclopenta[c]furo[3',2':4,5]furo[2,3-h][1]benzopyran-1,11-dione, 4,9a-Dihydroxy-2,3,6a,9a-tetrahydrocyclopenta[c]furo[3',2':4,5]furo[2,3-h][1]benzopyran-1,11-dione
| Molecular Formula | C16H10O7 |
| Molecular Weight | 314.04266 g/mol |
| XLogP | 0.2 |
| Topological Polar Surface Area (TPSA) | 102.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 0 |
| Exact Mass | 314.04266 Da |
| Heavy Atoms | 23 |
| Complexity | 680.0 |
| SMILES | C1CC(=O)C2=C1C3=C(C4=C(C=C3O)O[C@@H]5[C@]4(C=CO5)O)OC2=O |
| InChIKey | DSVHKQSCPYUFHN-HZPDHXFCSA-N |
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Cyclopenta(c)furo(3',2':4,5)furo(2,3-h)(1)benzopyran-1,11-dione, 2,3,6a,9a-tetrahydro-4,9a-dihydroxy-, (6aR-cis)-. The TPSA of 102.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Cyclopenta(c)furo(3',2':4,5)furo(2,3-h)(1)benzopyran-1,11-dione, 2,3,6a,9a-tetrahydro-4,9a-dihydroxy-, (6aR-cis)-. Following Lipinski's Rule of Five, Cyclopenta(c)furo(3',2':4,5)furo(2,3-h)(1)benzopyran-1,11-dione, 2,3,6a,9a-tetrahydro-4,9a-dihydroxy-, (6aR-cis)- has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Cyclopenta(c)furo(3',2':4,5)furo(2,3-h)(1)benzopyran-1,11-dione, 2,3,6a,9a-tetrahydro-4,9a-dihydroxy-, (6aR-cis)- is 113568-92-6.
The molecular formula of Cyclopenta(c)furo(3',2':4,5)furo(2,3-h)(1)benzopyran-1,11-dione, 2,3,6a,9a-tetrahydro-4,9a-dihydroxy-, (6aR-cis)- is C16H10O7.
The molecular weight of Cyclopenta(c)furo(3',2':4,5)furo(2,3-h)(1)benzopyran-1,11-dione, 2,3,6a,9a-tetrahydro-4,9a-dihydroxy-, (6aR-cis)- is 314.04266 g/mol.
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