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Substance Name: Pobilukast edamine [USAN]
RN: 137232-03-2
UNII: 8270528Z3Y
InChIKey: DIUCVZXIHDZZBV-LBDKHHEASA-N

Note

  • A leukotriene receptor antagonist; an antiasthmatic agent.

Classification Codes

  • Anti-Asthmatic (Leukotriene Antagonist)
  • Leukotriene Antagonists

Molecular Formula

  • C26-H34-O5-S.C2-H8-N2.H2-O

Molecular Weight

  • 536.7296
 
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Names and Synonyms

Name of Substance

  • Pobilukast edamine [USAN]

Synonyms

  • (2S,3R)-3-((2-Carboxyethyl)thio)-3-(o-(8-phenyloctyl)phenyl)lactic acid, compound with ethylenediamine (1:1), monohydrate
  • Benzenepropanoic acid, beta-((2-carboxyethyl)thio)-alpha-hydroxy-2-(8-phenyloctyl)-, (R-(R*,S*))-, compd. with 1,2-ethanediamine (1:1), monohydrate
  • Pobilukast edamine
  • Pobilukast edamine hydrate
  • SK&F 104353-Q
  • UNII-8270528Z3Y

Registry Numbers

CAS Registry Number

  • 137232-03-2

FDA UNII

  • 8270528Z3Y

System Generated Number

  • 0137232032

Molecular Formulas

Molecular Formula

  • C26-H34-O5-S.C2-H8-N2.H2-O

Molecular Formula Fragments

  • C2-H8-N2
  • C26-H34-O5-S
  • COMPONENT
  • H2-O

Structure Descriptors

InChI

1S/C26H34O5S.C2H8N2.H2O/c27-23(28)18-19-32-25(24(29)26(30)31)22-17-11-10-16-21(22)15-9-4-2-1-3-6-12-20-13-7-5-8-14-20;3-1-2-4;/h5,7-8,10-11,13-14,16-17,24-25,29H,1-4,6,9,12,15,18-19H2,(H,27,28)(H,30,31);1-4H2;1H2/t24-,25-;;/m1../s1

InChIKey

DIUCVZXIHDZZBV-LBDKHHEASA-N

Smiles

O.NCCN.O[C@H]([C@H](SCCC(=O)O)c1ccccc1CCCCCCCCc2ccccc2)C(=O)O