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CHEBI:187373 - 4'-Hydroxy-5,7,2'-trimethoxyflavanone 4'-rhamnosyl-(1->6)-glucoside

ChEBI IDCHEBI:187373
ChEBI Name4'-Hydroxy-5,7,2'-trimethoxyflavanone 4'-rhamnosyl-(1->6)-glucoside
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC30H38O15
Net Charge0
Average Mass638.619
Monoisotopic Mass638.22107
SMILESCOc1cc(OC)c2c(c1)OC(c1ccc(O[C@@H]3OC(CO[C@@H]4OC(C)[C@H](O)C(O)[C@@H]4O)[C@@H](O)[C@H](O)C3O)cc1OC)CC2=O
InChIInChI=1S/C30H38O15/c1-12-23(32)25(34)27(36)29(42-12)41-11-21-24(33)26(35)28(37)30(45-21)43-13-5-6-15(17(7-13)39-3)18-10-16(31)22-19(40-4)8-14(38-2)9-20(22)44-18/h5-9,12,18,21,23-30,32-37H,10-11H2,1-4H3/t12?,18?,21?,23-,24+,25?,26-,27-,28?,29+,30+/m0/s1
InChIKeyCPNDUJFPOGZJOE-XFXHYWGLSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
ChEBI Ontology
Outgoing Relation(s)
4'-Hydroxy-5,7,2'-trimethoxyflavanone 4'-rhamnosyl-(1->6)-glucoside (CHEBI:187373) is a flavonoids (CHEBI:72544)
4'-Hydroxy-5,7,2'-trimethoxyflavanone 4'-rhamnosyl-(1->6)-glucoside (CHEBI:187373) is a glycoside (CHEBI:24400)
IUPAC Name 
5,7-dimethoxy-2-[2-methoxy-4-[(2S,4S,5S)-3,4,5-trihydroxy-6-[[(2R,3S,5R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxyphenyl]-2,3-dihydrochromen-4-one
Manual XrefsDatabases
24846498ChemSpider
LMPK12140461LIPID MAPS