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Substance Name: Pergolide sulfone
RN: 72822-03-8
InChIKey: BRFHHAXHZFOBNY-DQYPLQBXSA-N

Note

  • Pergolide microbial metabolite.

Molecular Weight

  • 346.492
 
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Names and Synonyms

Name of Substance

  • Pergolide sulfone

Systematic Name

  • Ergoline, 8-((methylsulfonyl)methyl)-6-propyl-, (8beta)-

Registry Numbers

CAS Registry Number

  • 72822-03-8

System Generated Number

  • 0072822038

Structure Descriptors

InChI

1S/C19H26N2O2S/c1-3-7-21-11-13(12-24(2,22)23)8-16-15-5-4-6-17-19(15)14(10-20-17)9-18(16)21/h4-6,10,13,16,18,20H,3,7-9,11-12H2,1-2H3/t13-,16?,18-/m1/s1

InChIKey

BRFHHAXHZFOBNY-DQYPLQBXSA-N

Smiles

[nH]1cc2C[C@H]3[N@@](C[C@@H](C[C@@H]3c3cccc1c23)CS(=O)(=O)C)CCC