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Content language

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Concept information

Preferred term

کافئیک اسید 3 سولفات (2)  

Type

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

charge

  • -2

formula

  • C9H6O7S

has_functional_parent

inchi

  • InChI=1S/C9H8O7S/c10-7-3-1-6(2-4-9(11)12)5-8(7)16-17(13,14)15/h1-5,10H,(H,11,12)(H,13,14,15)/p-2/b4-2+

inchikey

  • VWQNTRNACRFUCQ-DUXPYHPUSA-L

mass

  • 258.206

monoisotopicmass

  • 257.98452

smiles

  • O(C=1C=C(/C=C/C([O-])=O)C=CC1O)S([O-])(=O)=O

subset

  • 3_STAR

synonym EXACT

  • (2E)-3-[4-hydroxy-3-(sulfonatooxy)phenyl]prop-2-enoate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:133740

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