CHEBI:184881 - 5-O-Methylleridol

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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 5-O-Methylleridol
ChEBI ID CHEBI:184881
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C19H20O5
Net Charge 0
Average Mass 328.364
Monoisotopic Mass 328.13107
InChI InChI=1S/C19H20O5/c1-11-17(22-2)13(10-20)19(23-3)16-14(21)9-15(24-18(11)16)12-7-5-4-6-8-12/h4-8,15,20H,9-10H2,1-3H3
InChIKey ZHZVKKUTTLMHKX-UHFFFAOYSA-N
SMILES O1C(CC(=O)C=2C1=C(C(OC)=C(C2OC)CO)C)C3=CC=CC=C3
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 5-O-Methylleridol (CHEBI:184881) is a ether (CHEBI:25698)
5-O-Methylleridol (CHEBI:184881) is a flavonoids (CHEBI:72544)
IUPAC Name
6-(hydroxymethyl)-5,7-dimethoxy-8-methyl-2-phenyl-2,3-dihydrochromen-4-one
Manual Xrefs Databases
24846327 ChemSpider
LMPK12140200 LIPID MAPS
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