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CHEBI:169009 - {3-[(1E)-3-hydroxyprop-1-en-1-yl]phenyl}oxidanesulfonic acid

ChEBI IDCHEBI:169009
ChEBI Name{3-[(1E)-3-hydroxyprop-1-en-1-yl]phenyl}oxidanesulfonic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC9H10O5S
Net Charge0
Average Mass230.241
Monoisotopic Mass230.02489
SMILESO=S(=O)(O)Oc1cccc(/C=C/CO)c1
InChIInChI=1S/C9H10O5S/c10-6-2-4-8-3-1-5-9(7-8)14-15(11,12)13/h1-5,7,10H,6H2,(H,11,12,13)/b4-2+
InChIKeyHWTANBHBZMECOV-DUXPYHPUSA-N
Species of MetaboliteComponentSourceComments
Malus domestica (ncbitaxon:3750) exocarp (BTO:0000733) MetaboLights (MTBLS2384) Strain: Malus x domestica Borkh. cv. Ruixue
ChEBI Ontology
Outgoing Relation(s)
{3-[(1E)-3-hydroxyprop-1-en-1-yl]phenyl}oxidanesulfonic acid (CHEBI:169009) is a aryl sulfate (CHEBI:37919)
IUPAC Name 
[3-[(E)-3-hydroxyprop-1-enyl]phenyl] hydrogen sulate
Manual XrefsDatabases
HMDB0135303HMDB
74853787ChemSpider