CHEBI:185728 - Diffutidin

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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 Diffutidin
ChEBI ID CHEBI:185728
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C17H18O5
Net Charge 0
Average Mass 302.326
Monoisotopic Mass 302.11542
InChI InChI=1S/C17H18O5/c1-20-15-5-3-10(7-17(15)21-2)14-6-4-12-13(19)8-11(18)9-16(12)22-14/h3,5,7-9,14,18-19H,4,6H2,1-2H3/t14-/m0/s1
InChIKey NMMYBAVYBMEWOL-AWEZNQCLSA-N
SMILES O1[C@@H](CCC=2C1=CC(O)=CC2O)C3=CC(OC)=C(OC)C=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 Diffutidin (CHEBI:185728) is a ether (CHEBI:25698)
Diffutidin (CHEBI:185728) is a flavonoids (CHEBI:72544)
IUPAC Name
(2S)-2-(3,4-dimethoxyphenyl)-3,4-dihydro-2H-chromene-5,7-diol
Manual Xrefs Databases
24842661 ChemSpider
LMPK12020268 LIPID MAPS
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