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CHEBI:186782 - Quercetin 3-methyl ether 7-alpha-L-arabinofuranosyl-(1->6)-glucoside

ChEBI IDCHEBI:186782
ChEBI NameQuercetin 3-methyl ether 7-alpha-L-arabinofuranosyl-(1->6)-glucoside
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC27H30O16
Net Charge0
Average Mass610.521
Monoisotopic Mass610.15338
SMILESCOc1c(-c2ccc(O)c(O)c2)oc2cc(O[C@@H]3OC(CO[C@@H]4O[C@@H](CO)C(O)[C@@H]4O)[C@@H](O)[C@H](O)C3O)cc(O)c2c1=O
InChIInChI=1S/C27H30O16/c1-38-25-20(34)17-13(31)5-10(6-14(17)41-24(25)9-2-3-11(29)12(30)4-9)40-27-23(37)21(35)19(33)16(43-27)8-39-26-22(36)18(32)15(7-28)42-26/h2-6,15-16,18-19,21-23,26-33,35-37H,7-8H2,1H3/t15-,16?,18?,19+,21-,22-,23?,26+,27+/m0/s1
InChIKeyJJEZLDBGCYBPQK-IPLHALJGSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
ChEBI Ontology
Outgoing Relation(s)
Quercetin 3-methyl ether 7-alpha-L-arabinofuranosyl-(1->6)-glucoside (CHEBI:186782) is a flavonoids (CHEBI:72544)
Quercetin 3-methyl ether 7-alpha-L-arabinofuranosyl-(1->6)-glucoside (CHEBI:186782) is a glycoside (CHEBI:24400)
IUPAC Name 
7-[(2S,4S,5S)-6-[[(2R,3S,5S)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-2-(3,4-dihydroxyphenyl)-5-hydroxy-3-methoxychromen-4-one
Manual XrefsDatabases
24845366ChemSpider
LMPK12112712LIPID MAPS