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CHEBI:186367 - 5-O-Methyleriodictyol 7-glucosyl-(1->4)-galactoside

ChEBI IDCHEBI:186367
ChEBI Name5-O-Methyleriodictyol 7-glucosyl-(1->4)-galactoside
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC28H34O16
Net Charge0
Average Mass626.564
Monoisotopic Mass626.18469
SMILESCOc1cc(OC2OC(CO)C(OC3OC(CO)C(O)C(O)C3O)C(O)C2O)cc2c1C(=O)CC(c1ccc(O)c(O)c1)O2
InChIInChI=1S/C28H34O16/c1-39-16-5-11(6-17-20(16)14(33)7-15(41-17)10-2-3-12(31)13(32)4-10)40-27-25(38)23(36)26(19(9-30)43-27)44-28-24(37)22(35)21(34)18(8-29)42-28/h2-6,15,18-19,21-32,34-38H,7-9H2,1H3
InChIKeyCEJOKNKJINIMGF-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
ChEBI Ontology
Outgoing Relation(s)
5-O-Methyleriodictyol 7-glucosyl-(1->4)-galactoside (CHEBI:186367) is a flavonoids (CHEBI:72544)
5-O-Methyleriodictyol 7-glucosyl-(1->4)-galactoside (CHEBI:186367) is a glycoside (CHEBI:24400)
IUPAC Name 
7-[3,4-dihydroxy-6-(hydroxymethyl)-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-2-(3,4-dihydroxyphenyl)-5-methoxy-2,3-dihydrochromen-4-one
Manual XrefsDatabases
LMPK12140560LIPID MAPS
24846558ChemSpider
HMDB0040470HMDB