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CHEBI:180702 - [6-hydroxy-2-methoxy-3-(3-phenylprop-2-en-1-yl)phenyl]oxidanesulfonic acid

ChEBI IDCHEBI:180702
ChEBI Name[6-hydroxy-2-methoxy-3-(3-phenylprop-2-en-1-yl)phenyl]oxidanesulfonic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H16O6S
Net Charge0
Average Mass336.365
Monoisotopic Mass336.06676
SMILESCOc1c(C/C=C/c2ccccc2)ccc(O)c1OS(=O)(=O)O
InChIInChI=1S/C16H16O6S/c1-21-15-13(9-5-8-12-6-3-2-4-7-12)10-11-14(17)16(15)22-23(18,19)20/h2-8,10-11,17H,9H2,1H3,(H,18,19,20)/b8-5+
InChIKeyYQNUPNWAJIQBFJ-VMPITWQZSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606)
blood serum (BTO:0000133) MetaboLights (MTBLS2150)
blood serum (BTO:0000133) MetaboLights (MTBLS2150)
blood serum (BTO:0000133) MetaboLights (MTBLS2150)
ChEBI Ontology
Outgoing Relation(s)
[6-hydroxy-2-methoxy-3-(3-phenylprop-2-en-1-yl)phenyl]oxidanesulfonic acid (CHEBI:180702) is a phenols (CHEBI:33853)
IUPAC Name 
[6-hydroxy-2-methoxy-3-[(E)-3-phenylprop-2-enyl]phenyl] hydrogen sulate
Manual XrefsDatabases
74852838ChemSpider
HMDB0130346HMDB