Ingenol 2,4,6,8,10-tetradecapentaenoate
[5,6-dihydroxy-7-(hydroxymethyl)-3,11,11,14-tetramethyl-15-oxo-4-tetracyclo[7.5.1.01,5.010,12]pentadeca-2,7-dienyl] (2E,4E,6E,8E,10E)-tetradeca-2,4,6,8,10-pentaenoate
Also Known As: Ingenol 2,4,6,8,10-tetradecapentaenoate
CAS: 42483-56-7
| Molecular Formula | C34H44O6 |
|---|---|
| Molecular Weight | 548.3138 g/mol |
| LogP | 4.9472 |
| Topological Polar Surface Area | 104.06 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 548.3138 |
| Monoisotopic Mass | 548.3138 |
| Heavy Atoms | 40 |
| Complexity | 1212.6564 |
Chemical Identifiers
| CAS Number | 42483-56-7 |
|---|---|
| SMILES | CCC/C=C/C=C/C=C/C=C/C=C/C(=O)OC1C(=CC23C1(C(C(=CC(C2=O)C4C(C4(C)C)CC3C)CO)O)O)C |
Product Overview
Ingenol 2,4,6,8,10-tetradecapentaenoate (CAS 42483-56-7), with molecular formula C34H44O6 and molecular weight 548.3138 g/mol. IUPAC: [5,6-dihydroxy-7-(hydroxymethyl)-3,11,11,14-tetramethyl-15-oxo-4-tetracyclo[7.5.1.01,5.010,12]pentadeca-2,7-dienyl] (2E,4E,6E,8E,10E)-tetradeca-2,4,6,8,10-pentaenoate.
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.
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