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(2R)-2-[(2R,3R,3aR,6S,7S,9bR)-6-(2-Carboxyethyl)-2-hydroxy-7-isopropenyl-3a,6,9b-trimethyl-2,3,3a,4,6,7,8,9b-octahydro-1H-cyclopenta[a]naphthalen-3-yl]-6-methyl-5-methyleneheptanoic acid(CAS: 137551-38-3)

(2R)-2-[(2R,3R,3aR,6S,7S,9bR)-6-(2-Carboxyethyl)-2-hydroxy-7-isopropenyl-3a,6,9b-trimethyl-2,3,3a,4,6,7,8,9b-octahydro-1H-cyclopenta[a]naphthalen-3-yl]-6-methyl-5-methyleneheptanoic acid
CAS Number

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Basic Information

Molecular Formula
C31H46O5
Molecular Weight
498.69 g/mol
Physical State
Powder

Chemical Identifiers

SMILES
CC(C)C(=C)CC[C@H]([C@H]1[C@@H](C[C@@]2([C@@]1(CC=C3C2=CC[C@H]([C@]3(C)CCC(=O)O)C(=C)C)C)C)O)C(=O)O
InChIKey
KVAQLXUMUVEKGR-SMFZDKLCSA-N

Database References

MDL Number
MFCD29049473

FAQ

This compound is a crystalline solid with a high melting point. Its molecular weight is approximately 522.5 g/mol. It has limited water solubility but shows good solubility in organic solvents. The compound is reactive and prone to hydrolysis under basic conditions and can also undergo ring-opening reactions. It is used in pharmaceuticals and advanced materials due to its unique chemical structure.
The compound is synthesized via a multistep process involving key steps such as alkylation, ring formation, and introduction of the carboxyethyl group. Specific catalysts and reagents are used to control the stereochemistry and ensure high selectivity. The overall yield is moderate to good, depending on the optimization of reaction conditions.
This compound is primarily used in pharmaceuticals for developing new drugs and in advanced materials for applications such as sensors and semiconductors. It is also explored for use in polymer synthesis and as a precursor for other chemical intermediates.
When handling this compound, wear appropriate personal protective equipment (PPE) including gloves, safety goggles, and a lab coat. Work in a well-ventilated area or fume hood to minimize exposure to air. Store the compound in a cool, dry place away from heat sources. In case of a spill, carefully clean up using appropriate absorbent materials and dispose of according to local regulations. Always refer to the Safety Data Sheet (SDS) for detailed handling and disposal information.

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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