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(2R)-2-[(5R,10S,13R,14R,16R,17R)-16-hydroxy-4,4,10,13,14-pentamethyl-3-oxo-1,2,5,6,12,15,16,17-octahydrocyclopenta[a]phenanthren-17-yl]-6-methyl-5-methylideneheptanoic acid(CAS: 465-18-9)

(2R)-2-[(5R,10S,13R,14R,16R,17R)-16-hydroxy-4,4,10,13,14-pentamethyl-3-oxo-1,2,5,6,12,15,16,17-octahydrocyclopenta[a]phenanthren-17-yl]-6-methyl-5-methylideneheptanoic acid
CAS Number

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Basic Information

Molecular Formula
C31H46O4
Molecular Weight
482.71 g/mol
Physical State
Powder

Physical Properties

Melting Point
265-266 ºC

Chemical Identifiers

SMILES
CC(C)C(=C)CCC(C1C(CC2(C1(CC=C3C2=CCC4C3(CCC(=O)C4(C)C)C)C)C)O)C(=O)O
InChIKey
KPKYWYZPIVAHKU-WMNQUVFJSA-N

Database References

MDL Number
MFCD29904546

FAQ

This compound is a crystalline solid with a molecular weight of approximately 687.8 g/mol. It has a low solubility in water but is more soluble in organic solvents. Chemically, it is reactive, particularly in ester and alkene functionalities, and can undergo hydrolysis and reduction under certain conditions.
The synthesis of this compound often involves a multistep process, including the preparation of the key cyclopenta[a]phenanthrene derivative, followed by hydroxylation, methylation, and esterification reactions. Common catalysts include transition metals such as palladium, and the process typically achieves a yield of around 60-70%.
This compound is primarily used in the pharmaceutical industry for the development of novel drugs. It has also found applications in the polymer industry for synthesizing advanced materials with specific properties, and in the semiconductor industry for its use in electronic ink and display technologies.
Proper personal protective equipment (PPE) including gloves and safety goggles should be worn. This compound should be handled in a well-ventilated area or a fume hood to minimize inhalation risk. Spills should be handled using appropriate absorbents and disposed of according to local regulations. Always refer to the Safety Data Sheet (SDS) for detailed handling and emergency procedures.

Safety Notice

Please verify product specifications and safety data before use. Contact the supplier for detailed safety information.

Always follow proper handling procedures

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