CHEBI:186623 - Flemiflavanone D

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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 Flemiflavanone D
ChEBI ID CHEBI:186623
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C25H28O6
Net Charge 0
Average Mass 424.493
Monoisotopic Mass 424.18859
InChI InChI=1S/C25H28O6/c1-13(2)5-7-16-18(27)11-19(28)23-20(29)12-21(30-24(16)23)14-6-8-17(26)15(9-14)10-22-25(3,4)31-22/h5-6,8-9,11,21-22,26-28H,7,10,12H2,1-4H3
InChIKey NTHBAQJPQOMDRE-UHFFFAOYSA-N
SMILES O1C(C1CC=2C=C(C3OC=4C(C(=O)C3)=C(O)C=C(O)C4CC=C(C)C)C=CC2O)(C)C
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 Flemiflavanone D (CHEBI:186623) is a flavanones (CHEBI:28863)
IUPAC Name
2-[3-[(3,3-dimethyloxiran-2-yl)methyl]-4-hydroxyphenyl]-5,7-dihydroxy-8-(3-methylbut-2-enyl)-2,3-dihydrochromen-4-one
Manual Xrefs Databases
24846387 ChemSpider
LMPK12140284 LIPID MAPS
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