(2S,2’S)-1,1’-[[(3-Hydroxytricyclo[3.3.1.13,7]dec-1-yl)imino]bis(1-oxo-2,1-ethanediyl)]bis-2-pyrroli - CAS 1036959-23-5

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Catalog Number: R062545

CAS Number: 1036959-23-5

PubChem Substance ID:355055694

Molecular Formula: C24H33N5O3

Molecular Weight:439.56

Purity: ≥95%

* For research use only. Not for human or veterinary use.

Synonym

• Synonyms: Vildagliptin Impurity B

Property

• Molecular Formula: C24H33N5O3
• Molecular Weight: 439.56
• Purity: ≥95%
• Storage: Store at -20°C

Computed Descriptor

• IUPAC Name: (2S)-1-[2-[[2-[(2S)-2-cyanopyrrolidin-1-yl]-2-oxoethyl]-(3-hydroxy-1-adamantyl)amino]acetyl]pyrrolidine-2-carbonitrile
• InChI: InChI=1S/C24H33N5O3/c25-12-19-3-1-5-28(19)21(30)14-27(15-22(31)29-6-2-4-20(29)13-26)23-8-17-7-18(9-23)11-24(32,10-17)16-23/h17-20,32H,1-11,14-16H2/t17?,18?,19-,20-,23?,24?/m0/s1
• InChIKey: UBWUDDDAHPQAQV-SLICPZRKSA-N
• SMILES: C1CC(N(C1)C(=O)CN(CC(=O)N2CCCC2C#N)C34CC5CC(C3)CC(C5)(C4)O)C#N