CHEBI:187282 - Yinyanghuo 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 Yinyanghuo D
ChEBI ID CHEBI:187282
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C20H18O5
Net Charge 0
Average Mass 338.359
Monoisotopic Mass 338.11542
InChI InChI=1S/C20H18O5/c1-11(2)3-4-12-7-13(5-6-15(12)22)18-10-17(24)20-16(23)8-14(21)9-19(20)25-18/h3,5-10,21-23H,4H2,1-2H3
InChIKey PFQMUQWFRINBBG-UHFFFAOYSA-N
SMILES O1C(C2=CC(CC=C(C)C)=C(O)C=C2)=CC(=O)C=3C1=CC(O)=CC3O
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 Yinyanghuo D (CHEBI:187282) is a flavones (CHEBI:24043)
IUPAC Name
5,7-dihydroxy-2-[4-hydroxy-3-(3-methylbut-2-enyl)phenyl]chromen-4-one
Manual Xrefs Databases
4474718 ChemSpider
LMPK12110415 LIPID MAPS
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Registry Number Type Source
119240-82-3 CAS Registry Number ChemIDplus