CHEBI:189730 - hesperetin 7-sulfate

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name hesperetin 7-sulfate
ChEBI ID CHEBI:189730
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C16H14O9S
Net Charge 0
Average Mass 382.340
Monoisotopic Mass 382.03585
InChI InChI=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
InChIKey SKHOIXCPISQFMS-AWEZNQCLSA-N
SMILES S(OC=1C=C2O[C@@H](CC(=O)C2=C(O)C1)C3=CC(O)=C(OC)C=C3)(O)(=O)=O
ChEBI Ontology
Outgoing 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 Xref Database
58782096 ChemSpider
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