NSC305533
8-hydroxy-8-[3-hydroxy-6-(hydroxymethyl)-4-oxopyran-2-yl]-3,11-dioxatricyclo[5.3.1.01,5]undecane-4,9-dione
Also Known As: hydroxy-[3-hydroxy-6-(hydroxymethyl)-4-oxo-pyran-2-yl][?]dione|6-Hydroxy-6-[3-hydroxy-6-(hydroxymethyl)-4-oxo-4H-pyran-2-yl]tetrahydro-1H,3H-3a,7-epoxycyclohepta[c]furan-1,5(4H)-dione|6-Hydroxy-6-[3-hydroxy-6-(hydroxymethyl)-4-oxo-4H-pyran-2-yl]tetrahydro-1H-3a,7-epoxycyclohepta[c]furan-1,5-dione|8-Hydroxy-8-[3-hydroxy-6-(hydroxymethyl)-4-oxopyran-2-yl]-3,11-dioxatricyclo[5.3.1.01,5]undecane-4,9-dione
| Molecular Formula | C15H14O9 |
|---|---|
| Molecular Weight | 338.06378 g/mol |
| LogP | -2.6 |
| Topological Polar Surface Area | 140.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 2 |
| Exact Mass | 338.06378 |
| Monoisotopic Mass | 338.06378 |
| Heavy Atoms | 24 |
| Complexity | 735.0 |
Chemical Identifiers
| CAS Number | 63702-76-1 |
|---|---|
| SMILES | C1C2C(=O)OCC23CC(=O)C(C1O3)(C4=C(C(=O)C=C(O4)CO)O)O |
| InChIKey | RWGQGHBQZAGYRO-UHFFFAOYSA-N |
Product Overview
NSC305533 (CAS 63702-76-1), with molecular formula C15H14O9 and molecular weight 338.06378 g/mol. IUPAC: 8-hydroxy-8-[3-hydroxy-6-(hydroxymethyl)-4-oxopyran-2-yl]-3,11-dioxatricyclo[5.3.1.01,5]undecane-4,9-dione.
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