BUFADIENOLIDE DERIV
[14-acetyloxy-7,11-dimethyl-6-(6-oxopyran-3-yl)-3-oxapentacyclo[8.8.0.02,4.02,7.011,16]octadecan-5-yl] propanoate
Also Known As: BUFADIENOLIDE DERIV|3-(Acetyloxy)-16-(propanoyloxy)-14,15-epoxybufa-20,22-dienolide|[14-Acetyloxy-7,11-dimethyl-6-(6-oxopyran-3-yl)-3-oxapentacyclo[8.8.0.02,4.02,7.011,16]octadecan-5-yl] propanoate
CAS: 76675-88-2
| Molecular Formula | C29H38O7 |
|---|---|
| Molecular Weight | 498.26175 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 91.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 498.26175 |
| Monoisotopic Mass | 498.26175 |
| Heavy Atoms | 36 |
| Complexity | 1050.0 |
Chemical Identifiers
| CAS Number | 76675-88-2 |
|---|---|
| SMILES | CCC(=O)OC1C(C2(CCC3C(C24C1O4)CCC5C3(CCC(C5)OC(=O)C)C)C)C6=COC(=O)C=C6 |
| InChIKey | SQOBVIVBZDIZBF-UHFFFAOYSA-N |
Product Overview
BUFADIENOLIDE DERIV (CAS 76675-88-2), with molecular formula C29H38O7 and molecular weight 498.26175 g/mol. IUPAC: [14-acetyloxy-7,11-dimethyl-6-(6-oxopyran-3-yl)-3-oxapentacyclo[8.8.0.02,4.02,7.011,16]octadecan-5-yl] propanoate.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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