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(11β,17E)-11,20-Dihydroxy-3-oxopregna-4,17-dien-21-al
[CAS# 105562-12-7]

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Identification
Name(11β,17E)-11,20-Dihydroxy-3-oxopregna-4,17-dien-21-al
Molecular StructureCAS # 105562-12-7, (11β,17E)-11,20-Dihydroxy-3-oxopregna-4,17-dien-21-al
Molecular FormulaC21H28O4
Molecular Weight344.44
CAS Registry Number105562-12-7
SMILESC[C@]12CCC(=O)C=C1CC[C@@H]3[C@@H]2[C@H](C[C@]4([C@H]3CC/C4=C(/C=O)O)C)O
Properties
Density1.2±0.1 g/cm3, Calc.*
Index of Refraction1.592, Calc.*
Boiling Point565.0±50.0 °C (760 mmHg), Calc.*
Flash Point309.6±26.6 °C, Calc.*
*Calculated using Advanced Chemistry Development (ACD/Labs) Software.
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