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Ezetimibe phenoxy glucuronide-D4
[CAS# 1426174-41-5]

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Identification
Classification API >> Special medicine >> Radioisotope
Name Ezetimibe phenoxy glucuronide-D4
Synonyms (2S,3S,4S,5R,6S)-6-[4-[(2S,3R)-3-[(3S)-3-(4-fluorophenyl)-3-hydroxypropyl]-4-oxo-1-(2,3,5,6-tetradeuterio-4-fluorophenyl)azetidin-2-yl]phenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
Molecular Structure CAS # 1426174-41-5, Ezetimibe phenoxy glucuronide-D4, (2S,3S,4S,5R,6S)-6-[4-[(2S,3R)-3-[(3S)-3-(4-fluorophenyl)-3-hydroxypropyl]-4-oxo-1-(2,3,5,6-tetradeuterio-4-fluorophenyl)azetidin-2-yl]phenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
Molecular Formula C30H25D4F2NO9
Molecular Weight 589.57
CAS Registry Number 1426174-41-5
SMILES [2H]C1=C(C(=C(C(=C1N2[C@@H]([C@H](C2=O)CC[C@@H](C3=CC=C(C=C3)F)O)C4=CC=C(C=C4)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)C(=O)O)O)O)O)[2H])[2H])F)[2H]
Properties
Density 1.5±0.1 g/cm3, Calc.*
Index of Refraction 1.650, Calc.*
Boiling Point 877.5±65.0 ºC (760 mmHg), Calc.*
Flash Point 484.5±34.3 ºC, Calc.*
* Calculated using Advanced Chemistry Development (ACD/Labs) Software.
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