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Concept information

Preferred term

PS 5  

Type

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

Broader concept

charge

  • 0

formula

  • C13H18N2O4S

inchi

  • InChI=1S/C13H18N2O4S/c1-3-8-9-6-10(20-5-4-14-7(2)16)11(13(18)19)15(9)12(8)17/h8-9H,3-6H2,1-2H3,(H,14,16)(H,18,19)/t8-,9-/m1/s1

inchikey

  • MHSNTZYKSLYGOM-RKDXNWHRSA-N

mass

  • 298.360

monoisotopicmass

  • 298.09873

smiles

  • N12[C@@]([C@@H](CC)C1=O)(CC(=C2C(O)=O)SCCNC(C)=O)[H]

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:81037

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