Rotenolone
(1R,6R,13R)-13-hydroxy-16,17-dimethoxy-6-prop-1-en-2-yl-2,7,20-trioxapentacyclo[11.8.0.03,11.04,8.014,19]henicosa-3(11),4(8),9,14,16,18-hexaen-12-one
| Molecular Formula | C23H22O7 |
|---|---|
| Molecular Weight | 410.4 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 83.5 A2 |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 410.13657 |
| Heavy Atoms | 30 |
| Complexity | 710.0 |
Chemical Identifiers
| CAS Number | 509-96-6 |
|---|---|
| SMILES | CC(=C)C1CC2=C(O1)C=CC3=C2OC4COC5=CC(=C(C=C5C4(C3=O)O)OC)OC |
| InChIKey | JFVKWCYZKMUTLH-AYPBNUJASA-N |
📖 Product Overview
Rotenolone (CAS: 509-96-6) is a chemical compound with molecular formula C23H22O7 and molecular weight 410.4 g/mol. Its IUPAC systematic name is (1R,6R,13R)-13-hydroxy-16,17-dimethoxy-6-prop-1-en-2-yl-2,7,20-trioxapentacyclo[11.8.0.03,11.04,8.014,19]henicosa-3(11),4(8),9,14,16,18-hexaen-12-one.
JFVKWCYZKMUTLH-AYPBNUJASA-N.
SMILES: CC(=C)C1CC2=C(O1)C=CC3=C2OC4COC5=CC(=C(C=C5C4(C3=O)O)OC)OC.
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