6-(Acetyloxy)-3,8,14-trihydroxy-1,2-epoxybufa-4,20,22-trienolide
[6,11,12-trihydroxy-2,16-dimethyl-15-(6-oxopyran-3-yl)-4-oxapentacyclo[9.7.0.02,8.03,5.012,16]octadec-7-en-9-yl] acetate
Also Known As: Neuro_000054|Scillirosidin,2.alpha.-epoxy-|Scillirosidin, 1.|A.,2.|A.-epoxy-|NCI60_000396|1.ALPHA.,2.ALPHA.-EPXOYSCILLIROSIDIN|6-(acetyloxy)-3,8,14-trihydroxy-1,2-epoxybufa-4,20,22-trienolide|1-[4-(6-Methyl-benzothiazol-2-yl)-phenyl]-3-phenyl-urea
| Molecular Formula | C26H32O8 |
|---|---|
| Molecular Weight | 472.20972 g/mol |
| LogP | 0.2 |
| Topological Polar Surface Area | 126.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 472.20972 |
| Monoisotopic Mass | 472.20972 |
| Heavy Atoms | 34 |
| Complexity | 1060.0 |
Chemical Identifiers
| CAS Number | 10271-07-5 |
|---|---|
| SMILES | CC(=O)OC1CC2(C(CCC3(C2(CCC3C4=COC(=O)C=C4)O)C)C5(C1=CC(C6C5O6)O)C)O |
| InChIKey | PQPYOTABGNYENP-UHFFFAOYSA-N |
Product Overview
6-(Acetyloxy)-3,8,14-trihydroxy-1,2-epoxybufa-4,20,22-trienolide (CAS 10271-07-5), with molecular formula C26H32O8 and molecular weight 472.20972 g/mol. IUPAC: [6,11,12-trihydroxy-2,16-dimethyl-15-(6-oxopyran-3-yl)-4-oxapentacyclo[9.7.0.02,8.03,5.012,16]octadec-7-en-9-yl] acetate.
6-(Acetyloxy)-3,8,14-trihydroxy-1,2-epoxybufa-4,20,22-trienolide is a custom synthesis product. We offer services from milligram to kilogram scale.
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