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CHEBI:189730 - hesperetin 7-sulfate

ChEBI IDCHEBI:189730
ChEBI Namehesperetin 7-sulfate
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SubmitterMetaboLights
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FormulaC16H14O9S
Net Charge0
Average Mass382.346
Monoisotopic Mass382.03585
SMILESCOc1ccc([C@@H]2CC(=O)c3c(O)cc(OS(=O)(=O)O)cc3O2)cc1O
InChIInChI=1S/C16H14O9S/c1-23-13-3-2-8(4-10(13)17)14-7-12(19)16-11(18)5-9(6-15(16)24-14)25-26(20,21)22/h2-6,14,17-18H,7H2,1H3,(H,20,21,22)/t14-/m0/s1
InChIKeySKHOIXCPISQFMS-AWEZNQCLSA-N
ChEBI Ontology
Outgoing Relation(s)
hesperetin 7-sulfate (CHEBI:189730) is a ether (CHEBI:25698)
hesperetin 7-sulfate (CHEBI:189730) is a flavonoids (CHEBI:72544)
IUPAC Name 
[(2S)-5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-4-oxo-2,3-dihydrochromen-7-yl] hydrogen sulate
Manual XrefsDatabases
58782096ChemSpider