EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:193427 - {4-[3-(3,5-dihydroxyphenyl)oxiran-2-yl]phenyl}oxidanesulfonic acid

ChEBI IDCHEBI:193427
ChEBI Name{4-[3-(3,5-dihydroxyphenyl)oxiran-2-yl]phenyl}oxidanesulfonic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC14H12O7S
Net Charge0
Average Mass324.310
Monoisotopic Mass324.03037
SMILESO=S(=O)(O)Oc1ccc(C2OC2c2cc(O)cc(O)c2)cc1
InChIInChI=1S/C14H12O7S/c15-10-5-9(6-11(16)7-10)14-13(20-14)8-1-3-12(4-2-8)21-22(17,18)19/h1-7,13-16H,(H,17,18,19)
InChIKeyMWXJFWBMMRUCIA-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) feces (BTO:0000440) MetaboLights (MTBLS5335)
ChEBI Ontology
Outgoing Relation(s)
{4-[3-(3,5-dihydroxyphenyl)oxiran-2-yl]phenyl}oxidanesulfonic acid (CHEBI:193427) is a stilbenoid (CHEBI:26776)
IUPAC Name 
[4-[3-(3,5-dihydroxyphenyl)oxiran-2-yl]phenyl] hydrogen sulate
Manual XrefsDatabases
74852264ChemSpider