AC1L8OKS
[5-formyloxy-7,11-dimethyl-6-(6-oxopyran-3-yl)-3-oxapentacyclo[8.8.0.02,4.02,7.011,16]octadecan-14-yl] acetate
Also Known As: BUFADIENOLIDE DERIV|3-(Acetyloxy)-16-(formyloxy)-14,15-epoxybufa-20,22-dienolide|[5-Formyloxy-7,11-dimethyl-6-(6-oxopyran-3-yl)-3-oxapentacyclo[8.8.0.02,4.02,7.011,16]octadecan-14-yl] acetate|Bufa-20, 3-(acetyloxy)-14,15-epoxy-16-(formyloxy)-, (3.beta.,5.beta.,15.beta.,16.beta.)-
CAS: 76675-87-1
| Molecular Formula | C27H34O7 |
|---|---|
| Molecular Weight | 470.23044 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 91.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 470.23044 |
| Monoisotopic Mass | 470.23044 |
| Heavy Atoms | 34 |
| Complexity | 985.0 |
Chemical Identifiers
| CAS Number | 76675-87-1 |
|---|---|
| SMILES | CC(=O)OC1CCC2(C(C1)CCC3C2CCC4(C35C(O5)C(C4C6=COC(=O)C=C6)OC=O)C)C |
| InChIKey | KZZFPEOLXOMJPV-UHFFFAOYSA-N |
Product Overview
AC1L8OKS (CAS 76675-87-1), with molecular formula C27H34O7 and molecular weight 470.23044 g/mol. IUPAC: [5-formyloxy-7,11-dimethyl-6-(6-oxopyran-3-yl)-3-oxapentacyclo[8.8.0.02,4.02,7.011,16]octadecan-14-yl] acetate.
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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