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CHEBI:229881 - lmpk12120146

ChEBI IDCHEBI:229881
ChEBI Namelmpk12120146
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC30H28O12
Net Charge0
Average Mass580.542
Monoisotopic Mass580.15808
SMILESO=C(/C=C/c1ccc(O)cc1)OC1[C@H](Oc2ccc(C(=O)/C=C/c3ccc(O)cc3)c(O)c2O)OC(CO)[C@@H](O)[C@@H]1O
InChIInChI=1S/C30H28O12/c31-15-23-27(38)28(39)29(42-24(35)14-6-17-3-9-19(33)10-4-17)30(41-23)40-22-13-11-20(25(36)26(22)37)21(34)12-5-16-1-7-18(32)8-2-16/h1-14,23,27-33,36-39H,15H2/b12-5+,14-6+/t23?,27-,28+,29?,30-/m1/s1
InChIKeyXKPBAPHWYIKWSN-FUSMMTQTSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) feces (BTO:0000440) MetaboLights (MTBLS9087)
ChEBI Ontology
Outgoing Relation(s)
lmpk12120146 (CHEBI:229881) is a flavonoids (CHEBI:72544)
lmpk12120146 (CHEBI:229881) is a glycoside (CHEBI:24400)
IUPAC Name 
[(2S,4S,5S)-2-[2,3-dihydroxy-4-[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]phenoxy]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl] (E)-3-(4-hydroxyphenyl)prop-2-enoate
Manual XrefsDatabases
24845911ChemSpider
LMPK12120146LIPID MAPS