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Concept information

Preferred term

834 B1  

Type

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

charge

  • 0

formula

  • C12H16O2S

inchi

  • InChI=1S/C12H16O2S/c1-5-8(3)7-12(6-2)10(13)9(4)11(14)15-12/h5,7,13H,1,6H2,2-4H3/b8-7+/t12-/m0/s1

inchikey

  • HBYOKPONWLKKRI-GUOLPTJISA-N

mass

  • 224.320

monoisotopicmass

  • 224.08710

smiles

  • S1C(=O)C(C)=C([C@@]1(/C=C(/C=C)/C)CC)O

subset

  • 2_STAR

synonym EXACT

  • (5S)-5-ethyl-4-hydroxy-3-methyl-5-[(1E)-2-methylbuta-1,3-dienyl]thiophen-2-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:221810

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