CHEBI:197150 - Afzelechin 5,4'-dimethyl ether

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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 Afzelechin 5,4'-dimethyl ether
ChEBI ID CHEBI:197150
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C17H18O5
Net Charge 0
Average Mass 302.326
Monoisotopic Mass 302.11542
InChI InChI=1S/C17H18O5/c1-20-12-5-3-10(4-6-12)17-14(19)9-13-15(21-2)7-11(18)8-16(13)22-17/h3-8,14,17-19H,9H2,1-2H3/t14-,17+/m0/s1
InChIKey WKYDSIJBQQASGS-WMLDXEAASA-N
SMILES O1[C@@H]([C@@H](O)CC2=C1C=C(O)C=C2OC)C3=CC=C(OC)C=C3
Metabolite of Species Details
Cannabis sativa (NCBI:txid3483) Found in inflorescence (BTO:0000628). of strain Cannabis sativa var. DMG265 See: MetaboLights Study
ChEBI Ontology
Outgoing Afzelechin 5,4'-dimethyl ether (CHEBI:197150) is a ether (CHEBI:25698)
Afzelechin 5,4'-dimethyl ether (CHEBI:197150) is a flavonoids (CHEBI:72544)
IUPAC Name
(2R,3S)-5-methoxy-2-(4-methoxyphenyl)-3,4-dihydro-2H-chromene-3,7-diol
Manual Xrefs Databases
24842577 ChemSpider
LMPK12020138 LIPID MAPS
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