(2S)-Hydroxy(phenyl)acetic acid - ethyl (2S,3S,4R)-4-(1,3-benzodioxol-5-yl)-2-(4-methoxyphenyl)-3-pyrrolidinecarboxylate
[CAS# 403614-49-3]

Identification

• Classification: Organic raw materials >> Heterocyclic compound >> Pyrroles
• Name: (2S)-Hydroxy(phenyl)acetic acid - ethyl (2S,3S,4R)-4-(1,3-benzodioxol-5-yl)-2-(4-methoxyphenyl)-3-pyrrolidinecarboxylate
• Molecular Formula: C₂₉H₃₁NO₈
• Molecular Weight: 521.56
• CAS Registry Number: 403614-49-3
• SMILES: CCOC(=O)[C@@H]1[C@@H](c2ccc(OC)cc2)NC[C@H]1c1ccc2c(c1)OCO2.O=C(O)[C@@H](O)c1ccccc1

Discovery and Applications

(2S)-Hydroxy(phenyl)acetic acid - ethyl (2S,3S,4R)-4-(1,3-benzodioxol-5-yl)-2-(4-methoxyphenyl)-3-pyrrolidinecarboxylate is a chemically complex chiral compound composed of two pharmacophore-rich substructures. The first is a hydroxy(phenyl)acetic acid derivative, commonly referred to as a mandelic acid analogue, and the second is a pyrrolidine-based structure featuring significant substitution at multiple positions. These two components are linked via an ester bond, forming a molecule with well-defined three-dimensional architecture and stereochemical specificity.

References

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