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CHEBI:185777 - Viscutin 3

ChEBI IDCHEBI:185777
ChEBI NameViscutin 3
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H22O9
Net Charge0
Average Mass406.387
Monoisotopic Mass406.12638
SMILESOc1cc(O[C@@H]2OC[C@@H](O)[C@H](O)C2O)c2c(c1)O[C@H](c1ccc(O)c(O)c1)CC2
InChIInChI=1S/C20H22O9/c21-10-6-16-11(2-4-15(28-16)9-1-3-12(22)13(23)5-9)17(7-10)29-20-19(26)18(25)14(24)8-27-20/h1,3,5-7,14-15,18-26H,2,4,8H2/t14-,15+,18+,19?,20+/m1/s1
InChIKeyPZVKVKGBUIREFM-XZOPPUQASA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
ChEBI Ontology
Outgoing Relation(s)
Viscutin 3 (CHEBI:185777) is a flavonoids (CHEBI:72544)
Viscutin 3 (CHEBI:185777) is a glycoside (CHEBI:24400)
IUPAC Name 
(2S,4S,5R)-2-[[(2S)-2-(3,4-dihydroxyphenyl)-7-hydroxy-3,4-dihydro-2H-chromen-5-yl]oxy]oxane-3,4,5-triol
Manual XrefsDatabases
LMPK12020264LIPID MAPS
24842657ChemSpider