Isotanshinone I
4,8-dimethylnaphtho[2,1-f][1]benzofuran-7,11-dione
Also Known As: Isotanshinone I|Isotanshinone|iso-Tanshinone I|4,8-Dimethylphenanthro[3,2-b]furan-7,11-dione|HY-N6649|FS-6990|4,8-dimethylnaphtho[2,1-f][1]benzofuran-7,11-dione|Phenanthro[3,2-b]furan-7,11-dione, 4,8-dimethyl-|4,8-Dimethylphenanthro[3,2-b]furan-7,11-dione #|4,8-DIMETHYLNAPHTHO(2,1-F)(1)BENZOFURAN-7,11-DIONE|Phenanthro(3,2-b)furan-7,11-dione, 4,8-dimethyl-|4,8-dimethyl-7H,11H-phenanthro[3,2-b]furan-7,11-dione
| Molecular Formula | C18H12O3 |
|---|---|
| Molecular Weight | 276.07864 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 47.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 276.07864 |
| Monoisotopic Mass | 276.07864 |
| Heavy Atoms | 21 |
| Complexity | 471.0 |
Chemical Identifiers
| CAS Number | 20958-17-2 |
|---|---|
| SMILES | CC1=C2C=CC3=C(C2=CC=C1)C(=O)C4=C(C3=O)C(=CO4)C |
| InChIKey | XYKZSUXWBGUGQV-UHFFFAOYSA-N |
Product Overview
Isotanshinone I (CAS 20958-17-2), with molecular formula C18H12O3 and molecular weight 276.07864 g/mol. IUPAC: 4,8-dimethylnaphtho[2,1-f][1]benzofuran-7,11-dione.
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