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CHEBI:181889 - 2-[4-[7-Hydroxy-3-(hydroxymethyl)-5-(3-hydroxypropyl)-2,3-dihydro-1-benzofuran-2-yl]-2-methoxyphenoxy]-6-methyloxane-3,4,5-triol

ChEBI IDCHEBI:181889
ChEBI Name2-[4-[7-Hydroxy-3-(hydroxymethyl)-5-(3-hydroxypropyl)-2,3-dihydro-1-benzofuran-2-yl]-2-methoxyphenoxy]-6-methyloxane-3,4,5-triol
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC25H32O10
Net Charge0
Average Mass492.521
Monoisotopic Mass492.19955
SMILESCOc1cc(C2Oc3c(O)cc(CCCO)cc3C2CO)ccc1OC1OC(C)C(O)C(O)C1O
InChIInChI=1S/C25H32O10/c1-12-20(29)21(30)22(31)25(33-12)34-18-6-5-14(10-19(18)32-2)23-16(11-27)15-8-13(4-3-7-26)9-17(28)24(15)35-23/h5-6,8-10,12,16,20-23,25-31H,3-4,7,11H2,1-2H3
InChIKeyPHHIEOZUONPPQY-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
2-[4-[7-Hydroxy-3-(hydroxymethyl)-5-(3-hydroxypropyl)-2,3-dihydro-1-benzofuran-2-yl]-2-methoxyphenoxy]-6-methyloxane-3,4,5-triol (CHEBI:181889) is a benzofurans (CHEBI:35259)
IUPAC Name 
2-[4-[7-hydroxy-3-(hydroxymethyl)-5-(3-hydroxypropyl)-2,3-dihydro-1-benzouran-2-yl]-2-methoxyphenoxy]-6-methyloxane-3,4,5-triol