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CHEBI:176435 - enterolactone 3''-glucuronide

ChEBI IDCHEBI:176435
ChEBI Nameenterolactone 3''-glucuronide
Stars
Submittermwilliams
DownloadsMolfile
FormulaC24H26O10
Net Charge0
Average Mass474.462
Monoisotopic Mass474.15260
SMILES[H][C@@]1(Cc2cccc(O[C@]3([H])O[C@]([H])(C(=O)O)[C@@]([H])(O)[C@]([H])(O)[C@@]3([H])O)c2)COC(=O)[C@@]1([H])Cc1cccc(O)c1
InChIInChI=1S/C24H26O10/c25-15-5-1-3-13(8-15)10-17-14(11-32-23(17)31)7-12-4-2-6-16(9-12)33-24-20(28)18(26)19(27)21(34-24)22(29)30/h1-6,8-9,14,17-21,24-28H,7,10-11H2,(H,29,30)/t14-,17+,18+,19+,20-,21+,24-/m1/s1
InChIKeyYPASCVZALRQWQG-NBSJFAFNSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:960) urine (BTO:0001419) MetaboLights (MTBLS2295)
ChEBI Ontology
Outgoing Relation(s)
enterolactone 3''-glucuronide (CHEBI:176435) is a O-acylcarnitine (CHEBI:17387)