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CHEBI:188118 - 3,4'-Dihydroxy-7,3',5'-trimethoxyflavone 3-galactosyl-(1->4)-xyloside

ChEBI IDCHEBI:188118
ChEBI Name3,4'-Dihydroxy-7,3',5'-trimethoxyflavone 3-galactosyl-(1->4)-xyloside
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC29H34O16
Net Charge0
Average Mass638.575
Monoisotopic Mass638.18469
SMILESCOc1ccc2c(=O)c(O[C@@H]3OC[C@@H](O[C@@H]4OC(CO)[C@H](O)[C@H](O)C4O)[C@H](O)C3O)c(-c3cc(OC)c(O)c(OC)c3)oc2c1
InChIInChI=1S/C29H34O16/c1-38-12-4-5-13-14(8-12)42-26(11-6-15(39-2)20(32)16(7-11)40-3)27(19(13)31)45-28-24(36)22(34)18(10-41-28)44-29-25(37)23(35)21(33)17(9-30)43-29/h4-8,17-18,21-25,28-30,32-37H,9-10H2,1-3H3/t17?,18-,21+,22+,23+,24?,25?,28+,29+/m1/s1
InChIKeyRVPRFBGAJPXOAQ-ACQXLXOTSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) blood plasma (BTO:0000131) MetaboLights (MTBLS2224)
ChEBI Ontology
Outgoing Relation(s)
3,4'-Dihydroxy-7,3',5'-trimethoxyflavone 3-galactosyl-(1->4)-xyloside (CHEBI:188118) is a flavonoids (CHEBI:72544)
3,4'-Dihydroxy-7,3',5'-trimethoxyflavone 3-galactosyl-(1->4)-xyloside (CHEBI:188118) is a glycoside (CHEBI:24400)
IUPAC Name 
3-[(2S,4R,5R)-3,4-dihydroxy-5-[(2S,4S,5R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-7-methoxychromen-4-one
Manual XrefsDatabases
24844353ChemSpider
LMPK12111575LIPID MAPS