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CHEBI:193869 - 2-[2-hydroxy-4-methoxy-3-(sulfooxy)phenyl]propanoic acid

ChEBI IDCHEBI:193869
ChEBI Name2-[2-hydroxy-4-methoxy-3-(sulfooxy)phenyl]propanoic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC10H12O8S
Net Charge0
Average Mass292.265
Monoisotopic Mass292.02529
SMILESCOc1ccc(C(C)C(=O)O)c(O)c1OS(=O)(=O)O
InChIInChI=1S/C10H12O8S/c1-5(10(12)13)6-3-4-7(17-2)9(8(6)11)18-19(14,15)16/h3-5,11H,1-2H3,(H,12,13)(H,14,15,16)
InChIKeyBOOAHQLKZAITPG-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
synthetic microbial community (ncbitaxon:3229850) Whole Organism (NCIT:C13413) MetaboLights (MTBLS3129)
ChEBI Ontology
Outgoing Relation(s)
2-[2-hydroxy-4-methoxy-3-(sulfooxy)phenyl]propanoic acid (CHEBI:193869) is a aryl sulfate (CHEBI:37919)
IUPAC Name 
2-(2-hydroxy-4-methoxy-3-sulooxyphenyl)propanoic acid
Manual XrefsDatabases
74853477ChemSpider