CHEBI:186153 - 2',4',4-Trihydroxy-3',3-dimethoxychalcone 4'-O-glucoside

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ChEBI Name 2',4',4-Trihydroxy-3',3-dimethoxychalcone 4'-O-glucoside
ChEBI ID CHEBI:186153
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C23H26O11
Net Charge 0
Average Mass 478.450
Monoisotopic Mass 478.14751
InChI InChI=1S/C23H26O11/c1-31-16-9-11(4-7-14(16)26)3-6-13(25)12-5-8-15(22(32-2)18(12)27)33-23-21(30)20(29)19(28)17(10-24)34-23/h3-9,17,19-21,23-24,26-30H,10H2,1-2H3/b6-3+/t17?,19-,20+,21?,23-/m1/s1
InChIKey LIYUMMBCLLSJKG-UMBKIMBVSA-N
SMILES O1C([C@@H](O)[C@H](O)C(O)[C@@H]1OC2=C(OC)C(O)=C(C=C2)C(=O)/C=C/C3=CC(OC)=C(O)C=C3)CO
Metabolite of Species Details
Mus musculus (NCBI:txid10090) Found in feces (BTO:0000440). of strain C57BL/6 Mouse [NCIT:C14424] See: MetaboLights Study
ChEBI Ontology
Outgoing 2',4',4-Trihydroxy-3',3-dimethoxychalcone 4'-O-glucoside (CHEBI:186153) is a flavonoids (CHEBI:72544)
2',4',4-Trihydroxy-3',3-dimethoxychalcone 4'-O-glucoside (CHEBI:186153) is a glycoside (CHEBI:24400)
IUPAC Name
(E)-3-(4-hydroxy-3-methoxyphenyl)-1-[2-hydroxy-3-methoxy-4-[(2S,4S,5S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]prop-2-en-1-one
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24845942 ChemSpider
LMPK12120180 LIPID MAPS
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