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CHEBI:175608 - (7'x,8'x)-4,7'-Epoxy-3,8'-bilign-7-ene-3,5'-dimethoxy-4',9,9'-triol

ChEBI IDCHEBI:175608
ChEBI Name(7'x,8'x)-4,7'-Epoxy-3,8'-bilign-7-ene-3,5'-dimethoxy-4',9,9'-triol
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SubmitterMetaboLights
DownloadsMolfile
FormulaC20H22O6
Net Charge0
Average Mass358.390
Monoisotopic Mass358.14164
SMILESCOc1cc(C2Oc3c(OC)cc(/C=C\CO)cc3C2CO)ccc1O
InChIInChI=1S/C20H22O6/c1-24-17-10-13(5-6-16(17)23)19-15(11-22)14-8-12(4-3-7-21)9-18(25-2)20(14)26-19/h3-6,8-10,15,19,21-23H,7,11H2,1-2H3/b4-3-
InChIKeyKUSXBOZNRPQEON-ARJAWSKDSA-N
ChEBI Ontology
Outgoing Relation(s)
(7'x,8'x)-4,7'-Epoxy-3,8'-bilign-7-ene-3,5'-dimethoxy-4',9,9'-triol (CHEBI:175608) is a benzofurans (CHEBI:35259)
IUPAC Name 
4-[3-(hydroxymethyl)-5-[(Z)-3-hydroxyprop-1-enyl]-7-methoxy-2,3-dihydro-1-benzouran-2-yl]-2-methoxyphenol
Manual XrefsDatabases
35015142ChemSpider
HMDB0041276HMDB