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CHEBI:189805 - 1-[2-(2H-1,3-benzodioxol-5-yl)-1-benzofuran-5-yl]propane-1,3-diol

ChEBI IDCHEBI:189805
ChEBI Name1-[2-(2H-1,3-benzodioxol-5-yl)-1-benzofuran-5-yl]propane-1,3-diol
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H16O5
Net Charge0
Average Mass312.321
Monoisotopic Mass312.09977
SMILESOCCC(O)c1ccc2oc(-c3ccc4c(c3)OCO4)cc2c1
InChIInChI=1S/C18H16O5/c19-6-5-14(20)11-1-3-15-13(7-11)9-17(23-15)12-2-4-16-18(8-12)22-10-21-16/h1-4,7-9,14,19-20H,5-6,10H2
InChIKeySYSZLYFEISZAME-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Sarcophaga peregrina (ncbitaxon:7386) Whole Organism (NCIT:C13413) MetaboLights (MTBLS4102)
ChEBI Ontology
Outgoing Relation(s)
1-[2-(2H-1,3-benzodioxol-5-yl)-1-benzofuran-5-yl]propane-1,3-diol (CHEBI:189805) is a benzofurans (CHEBI:35259)
IUPAC Name 
1-[2-(1,3-benzodioxol-5-yl)-1-benzouran-5-yl]propane-1,3-diol
Manual XrefsDatabases
HMDB0131335HMDB
74852921ChemSpider