Compound Q&A

What are the physical and chemical properties of N-[(3alpha,5beta,12alpha)-3,12-Dihydroxy-24-oxocholan-24-yl]glycine hydrate (CAS: 1079043-81-4)?

Answer

N-[(3alpha,5beta,12alpha)-3,12-Dihydroxy-24-oxocholan-24-yl]glycine hydrate (1:1)
N-[(3alpha,5beta,12alpha)-3,12-Dihydroxy-24-oxocholan-24-yl]glycine hydrate is a solid with a crystalline form. Its molecular weight is approximately 641.62 g/mol. The compound is moderately soluble in water and slightly soluble in ethanol. Chemically, it is inert under normal conditions but reacts with strong acids and bases. It has a pKa of about 10.5. This compound is typically stored in a desiccator to prevent moisture absorption.

About

English Name N-[(3alpha,5beta,12alpha)-3,12-Dihydroxy-24-oxocholan-24-yl]glycine hydrate (1:1)
Molecular Formula C26H45NO6
Molecular Weight 467.64700000000033 g/mol
SMILES C[C@H](CCC(=O)NCC(=O)O)[C@H]1CC[C@@H]2[C@@]1([C@H](C[C@H]3[C@H]2CC[C@H]4[C@@]3(CC[C@H](C4)O)C)O)C.O
InChIKey DLOTUJUSJVIXDW-YEUHZSMFSA-N
Last Updated: 2026-01-13 15:28

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