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Concept information

Preferred term

آسپیرون  

Type

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

charge

  • 0

formula

  • C9H12O4

inchi

  • InChI=1S/C9H12O4/c1-4-7(10)3-6(9(11)13-4)8-5(2)12-8/h3-5,7-8,10H,1-2H3/t4-,5+,7+,8-/m1/s1

inchikey

  • RCAULRNMJFUWRP-HETMPLHPSA-N

mass

  • 184.191

monoisotopicmass

  • 184.07356

smiles

  • [H][C@@]1(C)O[C@@]1([H])C1=C[C@H](O)[C@@H](C)OC1=O

subset

  • 3_STAR

synonym EXACT

  • (5S,6R)-5-hydroxy-6-methyl-3-[(2S,3S)-3-methyloxiran-2-yl]-5,6-dihydro-2H-pyran-2-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:156387

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