Agn-PC-0mwsis
3,8,9-trihydroxy-6-methoxy-3-methyl-7-(2,5,10-trihydroxy-7-methoxy-2-methyl-4-oxo-1,3-dihydroanthracen-9-yl)-2,4-dihydroanthracen-1-one
Also Known As: Phlegmacin|AGN-PC-0MWSIS|1,2',5',6,9,10'-HEXAHYDROXY-3,7'-DIMETHOXY-2',6-DIMETHYL-1',2',3',4',5,6,7,8-OCTAHYDRO-[2,9'-BIANTHRACENE]-4',8-DIONE|1,2',5',6,9,10'-Hexahydroxy-3,7'-dimethoxy-2',6-dimethyl-2',3',6,7-tetrahydro[2,9'-bianthracene]-4',8(1'H,5H)-dione|2 ,3 ,6,7-Tetrahydro-1,2 ,5 ,6,9,10 -hexahydroxy-3,7 -dimethoxy-2 ,6-dimethyl-2,9 -bianthracene-4 ,8(1 H,5H)-dione
| Molecular Formula | C32H30O10 |
|---|---|
| Molecular Weight | 574.1839 g/mol |
| LogP | 4.2594 |
| Topological Polar Surface Area | 173.98 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 3 |
| Exact Mass | 574.1839 |
| Monoisotopic Mass | 574.1839 |
| Heavy Atoms | 42 |
| Complexity | 1883.3 |
Chemical Identifiers
| CAS Number | 40501-61-9 |
|---|---|
| SMILES | CC1(CC2=C(C(=O)C1)C(=C3C(=C2)C=C(C(=C3O)C4=C5CC(CC(=O)C5=C(C6=C4C=C(C=C6O)OC)O)(C)O)OC)O)O |
Product Overview
Agn-PC-0mwsis (CAS 40501-61-9), with molecular formula C32H30O10 and molecular weight 574.1839 g/mol. IUPAC: 3,8,9-trihydroxy-6-methoxy-3-methyl-7-(2,5,10-trihydroxy-7-methoxy-2-methyl-4-oxo-1,3-dihydroanthracen-9-yl)-2,4-dihydroanthracen-1-one.
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