12-O-(Z,E)-2,4-Octadienoyl-4-desoxyphorbol
[(1R,2R,6R,10S,11R,13S,14R,15R)-1,13-dihydroxy-8-(hydroxymethyl)-4,12,12,15-tetramethyl-5-oxo-14-tetracyclo[8.5.0.02,6.011,13]pentadeca-3,8-dienyl] (2Z,4E)-octa-2,4-dienoate
Also Known As: 12-O-(Z,E)-2,4-Octadienoyl-4-desoxyphorbol|2,4-Octadienoic acid, 1a,1b,4,4a,5,7a,7b,8,9,9a-decahydro-7b,9a-dihydroxy-3-(hydroxymethyl)-1,1,6,8-tetramethyl-5-oxo-1H-cyclopropa(3,4)benz(1,2-e)azulen-9-yl ester, (1aR-(1aalpha,1bbeta,4aalpha,7aalpha,7balpha,8alpha,9beta(2Z,4E),9aalpha))-
| Molecular Formula | C28H38O6 |
|---|---|
| Molecular Weight | 470.26685 g/mol |
| LogP | 3.2786 |
| Topological Polar Surface Area | 104.06 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 470.26685 |
| Monoisotopic Mass | 470.26685 |
| Heavy Atoms | 34 |
| Complexity | 986.8554 |
Chemical Identifiers
| CAS Number | 70028-77-2 |
|---|---|
| SMILES | CCC/C=C/C=C\C(=O)O[C@@H]1[C@H]([C@@]2([C@@H]3C=C(C(=O)[C@@H]3CC(=C[C@H]2[C@H]4[C@@]1(C4(C)C)O)CO)C)O)C |
Product Overview
12-O-(Z,E)-2,4-Octadienoyl-4-desoxyphorbol (CAS 70028-77-2), with molecular formula C28H38O6 and molecular weight 470.26685 g/mol. IUPAC: [(1R,2R,6R,10S,11R,13S,14R,15R)-1,13-dihydroxy-8-(hydroxymethyl)-4,12,12,15-tetramethyl-5-oxo-14-tetracyclo[8.5.0.02,6.011,13]pentadeca-3,8-dienyl] (2Z,4E)-octa-2,4-dienoate.
12-O-(Z,E)-2,4-Octadienoyl-4-desoxyphorbol is a custom synthesis product. We offer services from milligram to kilogram scale.
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