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CHEBI:174634 - Dihydroferulic acid 4-sulfate

ChEBI IDCHEBI:174634
ChEBI NameDihydroferulic acid 4-sulfate
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC10H12O7S
Net Charge0
Average Mass276.266
Monoisotopic Mass276.03037
SMILESCOc1cc(CCC(=O)O)ccc1OS(=O)(=O)O
InChIInChI=1S/C10H12O7S/c1-16-9-6-7(3-5-10(11)12)2-4-8(9)17-18(13,14)15/h2,4,6H,3,5H2,1H3,(H,11,12)(H,13,14,15)
InChIKeyUMCDODPBPQMWQP-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Dihydroferulic acid 4-sulfate (CHEBI:174634) is a aryl sulfate (CHEBI:37919)
IUPAC Name 
3-(3-methoxy-4-sulooxyphenyl)propanoic acid
Manual XrefsDatabases
HMDB0041724HMDB
162994ChemSpider
Registry NumbersSources
CAS:86321-33-7ChemIDplus