Compound Q&A

What is Sodium 2-{[(3alpha,5beta,12alpha)-3,12-dihydroxy-24-oxocholan-24-yl]amino}ethanesulfonate hydrate (CAS: 207737-97-1)?

Answer

Sodium 2-{[(3alpha,5beta,12alpha)-3,12-dihydroxy-24-oxocholan-24-yl]amino}ethanesulfonate hydrate (1:1:1)
Sodium 2-{[(3alpha,5beta,12alpha)-3,12-dihydroxy-24-oxocholan-24-yl]amino}ethanesulfonate hydrate (CAS: 207737-97-1) is a compound with a complex structure, containing a choline ester backbone and a sodium salt. It is primarily used in pharmaceutical formulations as a choline donor and in research as a model compound for studying lipid metabolism.

About

English Name Sodium 2-{[(3alpha,5beta,12alpha)-3,12-dihydroxy-24-oxocholan-24-yl]amino}ethanesulfonate hydrate (1:1:1)
Molecular Formula C26H46NNaO7S
Molecular Weight 539.7 g/mol
SMILES CC(CCC(=O)NCCS(=O)(=O)[O-])C1CCC2C1(C(CC3C2CCC4C3(CCC(C4)O)C)O)C.O.[Na+]
InChIKey OLPIZAYYAVQETM-GGPRKOIFSA-M
Last Updated: 2025-09-15 09:35

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