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CAS 1138245-21-2

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Bicyclo[3.2.0]hept-3-ene-6-acetic acid, 6-(aminomethyl)-3-ethyl-, (1R,5S,6S)-, benzenesulfonate (1:1)

Description:
Bicyclo[3.2.0]hept-3-ene-6-acetic acid, 6-(aminomethyl)-3-ethyl-, (1R,5S,6S)-, benzenesulfonate (1:1) is a complex organic compound characterized by its bicyclic structure, which includes a heptene framework. The presence of an acetic acid moiety and an aminomethyl group contributes to its potential as a functionalized compound in organic synthesis. The specific stereochemistry indicated by the (1R,5S,6S) configuration suggests that the compound exhibits chirality, which can influence its reactivity and interactions in biological systems. The benzenesulfonate component enhances its solubility in polar solvents and may improve its stability and bioavailability. This compound may be of interest in medicinal chemistry due to its structural features, which could be relevant for drug design or as a biochemical probe. However, detailed studies on its physical properties, reactivity, and biological activity would be necessary to fully understand its potential applications and implications in various fields of chemistry and pharmacology.
Formula:C18H25NO5S
InChI:InChI=1S/C12H19NO2.C6H6O3S/c1-2-8-3-9-5-12(7-13,6-11(14)15)10(9)4-8;7-10(8,9)6-4-2-1-3-5-6/h4,9-10H,2-3,5-7,13H2,1H3,(H,14,15);1-5H,(H,7,8,9)/t9-,10-,12-;/m1./s1
InChI key:InChIKey=OKJXJRVWXYRSAN-TXULWXBWSA-N
SMILES:C(C(O)=O)[C@]1(CN)[C@]2([C@@](C1)(CC(CC)=C2)[H])[H].S(=O)(=O)(O)C1=CC=CC=C1
Synonyms:
  • DS 5565 besylate
  • Bicyclo[3.2.0]hept-3-ene-6-acetic acid, 6-(aminomethyl)-3-ethyl-, (1R,5S,6S)-, benzenesulfonate (1:1)
  • Mirogabalin besylate
  • Mirogabalin Besilate
  • Tarlige
  • Mirogabalin Besylate 10928
  • 2-((1R,5S,6S)-6-(aminomethyl)-3-ethylbicyclo[3.2.0]hept-3-en-6-yl)acetic acid compound with benzenesulfonic acid (1:1)
  • ((1R,5S,6S)-6-(carboxymethyl)-3-ethylbicyclo[3.2.0]hept-3-en-6-yl)methanaminium benzenesulfonate
  • Mirogabalin besylate (DS 5565 besylate)
  • [(1R,5S,6S)-6-(Aminomethyl)-3-ethylbicyclo[3.2.0] hept-3-en-6-yl]acetic acid benzenesulfonate
  • See more synonyms
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