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Terminolic acid [564-13-6]

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Name Terminolic acid
Synonyms (4aS,6aR,6aS,6bR,8R,8aR,9R,10R,11R,12aR,14bS)-8,10,11-trihydroxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid
Molecular Structure CAS # 564-13-6, Terminolic acid, (4aS,6aR,6aS,6bR,8R,8aR,9R,10R,11R,12aR,14bS)-8,10,11-trihydroxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid
Molecular Weight 504.70
CAS Registry Number 564-13-6
SMILES C[C@@]12CC[C@]3(CCC(C[C@H]3C1=CC[C@H]4[C@]2(C[C@H]([C@@H]5[C@@]4(C[C@H]([C@@H]([C@@]5(C)CO)O)O)C)O)C)(C)C)C(=O)O
Density 1.2±0.1 g/cm3, Calc.*
Index of Refraction 1.593, Calc.*
Boiling Point 638.1±55.0 ºC (760 mmHg), Calc.*
Flash Point 353.7±28.0 ºC, Calc.*
* Calculated using Advanced Chemistry Development (ACD/Labs) Software.
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