CHEBI:178250 - 5,7,4'-Trimethoxyflavan

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ChEBI Name 5,7,4'-Trimethoxyflavan
ChEBI ID CHEBI:178250
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C18H20O4
Net Charge 0
Average Mass 300.354
Monoisotopic Mass 300.13616
InChI InChI=1S/C18H20O4/c1-19-13-6-4-12(5-7-13)16-9-8-15-17(21-3)10-14(20-2)11-18(15)22-16/h4-7,10-11,16H,8-9H2,1-3H3
InChIKey NODOVAFZWHOGIU-UHFFFAOYSA-N
SMILES O1C(CCC2=C1C=C(OC)C=C2OC)C3=CC=C(OC)C=C3
ChEBI Ontology
Outgoing 5,7,4'-Trimethoxyflavan (CHEBI:178250) is a ether (CHEBI:25698)
5,7,4'-Trimethoxyflavan (CHEBI:178250) is a flavonoids (CHEBI:72544)
IUPAC Name
5,7-dimethoxy-2-(4-methoxyphenyl)-3,4-dihydro-2H-chromene
Manual Xrefs Databases
10554881 ChemSpider
LMPK12020277 LIPID MAPS
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Registry Number Type Source
4225-32-5 CAS Registry Number ChemIDplus