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Euphornin
[CAS# 80454-47-3]

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Identification
Classification Biochemical >> Natural biochemical product
Name Euphornin
Synonyms [(1S,2S,3aR,4S,5S,6Z,9R,11R,12Z,13aS)-4,9,11-triacetyloxy-3a-hydroxy-2,5,8,8,12-pentamethyl-2,3,4,5,9,10,11,13a-octahydro-1H-cyclopenta[12]annulen-1-yl] benzoate
Molecular Structure CAS # 80454-47-3, Euphornin, [(1S,2S,3aR,4S,5S,6Z,9R,11R,12Z,13aS)-4,9,11-triacetyloxy-3a-hydroxy-2,5,8,8,12-pentamethyl-2,3,4,5,9,10,11,13a-octahydro-1H-cyclopenta[12]annulen-1-yl] benzoate
Molecular Formula C33H44O9
Molecular Weight 584.70
CAS Registry Number 80454-47-3
SMILES C[C@H]1C[C@]2([C@H]([C@H]1OC(=O)C3=CC=CC=C3)/C=C(\[C@@H](C[C@H](C(/C=C\[C@@H]([C@@H]2OC(=O)C)C)(C)C)OC(=O)C)OC(=O)C)/C)O
Properties
Density 1.2±0.1 g/cm3, Calc.*
Index of Refraction 1.548, Calc.*
Boiling Point 624.1±55.0 ºC (760 mmHg), Calc.*
Flash Point 187.1±25.0 ºC, Calc.*
* Calculated using Advanced Chemistry Development (ACD/Labs) Software.
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