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CHEBI:180716 - [3-(4-methoxyphenyl)propoxy]sulfonic acid

ChEBI IDCHEBI:180716
ChEBI Name[3-(4-methoxyphenyl)propoxy]sulfonic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC10H14O5S
Net Charge0
Average Mass246.284
Monoisotopic Mass246.05619
SMILESCOc1ccc(CCCOS(=O)(=O)O)cc1
InChIInChI=1S/C10H14O5S/c1-14-10-6-4-9(5-7-10)3-2-8-15-16(11,12)13/h4-7H,2-3,8H2,1H3,(H,11,12,13)
InChIKeyLZRUJECSWOAXOK-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) blood serum (BTO:0000133) Article
ChEBI Ontology
Outgoing Relation(s)
[3-(4-methoxyphenyl)propoxy]sulfonic acid (CHEBI:180716) is a methoxybenzenes (CHEBI:51683)
IUPAC Name 
3-(4-methoxyphenyl)propyl hydrogen sulate
Manual XrefsDatabases
HMDB0135750HMDB
74853940ChemSpider