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Concept information

organooxygen compound > ester > sulfuric ester > alkyl sulfate > 4-hydroxy-5-(3'-hydroxyphenyl)-valeric acid-3'-o-sulphate

Preferred term

4-hydroxy-5-(3'-hydroxyphenyl)-valeric acid-3'-o-sulphate  

Type

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

charge

  • 0

formula

  • C11H14O7S

inchi

  • InChI=1S/C11H14O7S/c12-9(4-5-11(13)14)6-8-2-1-3-10(7-8)18-19(15,16)17/h1-3,7,9,12H,4-6H2,(H,13,14)(H,15,16,17)

inchikey

  • DMBFBGLRQKIWGT-UHFFFAOYSA-N

mass

  • 290.290

monoisotopicmass

  • 290.04602

smiles

  • C=1(C=C(C=CC1)CC(CCC(O)=O)O)OS(=O)(=O)O

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:88682

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