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Contact us: CRM@email.irandoc.ac.ir

Concept information

Preferred term

LY 117018  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

charge

  • 0

formula

  • C27H25NO4S

has_role

inchi

  • InChI=1S/C27H25NO4S/c29-20-7-3-19(4-8-20)27-25(23-12-9-21(30)17-24(23)33-27)26(31)18-5-10-22(11-6-18)32-16-15-28-13-1-2-14-28/h3-12,17,29-30H,1-2,13-16H2

inchikey

  • JLERVPBPJHKRBJ-UHFFFAOYSA-N

mass

  • 459.559

monoisotopicmass

  • 459.15043

smiles

  • S1C(=C(C2=C1C=C(O)C=C2)C(=O)C3=CC=C(OCCN4CCCC4)C=C3)C5=CC=C(O)C=C5

subset

  • 3_STAR

synonym EXACT

  • [6-hydroxy-2-(4-hydroxyphenyl)-1-benzothiophen-3-yl]{4-[2-(pyrrolidin-1-yl)ethoxy]phenyl}methanone

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:90187

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