CHEBI:185185 - Scutellarein 7,4'-dimethyl ether 6-glucoside

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Scutellarein 7,4'-dimethyl ether 6-glucoside
ChEBI ID CHEBI:185185
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C23H24O11
Net Charge 0
Average Mass 476.434
Monoisotopic Mass 476.13186
InChI InChI=1S/C23H24O11/c1-30-11-5-3-10(4-6-11)13-7-12(25)17-14(32-13)8-15(31-2)22(19(17)27)34-23-21(29)20(28)18(26)16(9-24)33-23/h3-8,16,18,20-21,23-24,26-29H,9H2,1-2H3/t16?,18-,20+,21?,23+/m1/s1
InChIKey ROLSKYQOJWBOTN-STYOUEQUSA-N
SMILES O1C([C@@H](O)[C@H](O)C(O)[C@@H]1OC=2C(O)=C3C(OC(=CC3=O)C4=CC=C(OC)C=C4)=CC2OC)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 Scutellarein 7,4'-dimethyl ether 6-glucoside (CHEBI:185185) is a flavonoids (CHEBI:72544)
Scutellarein 7,4'-dimethyl ether 6-glucoside (CHEBI:185185) is a glycoside (CHEBI:24400)
IUPAC Name
5-hydroxy-7-methoxy-2-(4-methoxyphenyl)-6-[(2S,4S,5S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
Manual Xrefs Databases
24844065 ChemSpider
LMPK12111130 LIPID MAPS
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