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CHEBI:197156 - Epicatechin 3',4'-dimethyl ether

ChEBI IDCHEBI:197156
ChEBI NameEpicatechin 3',4'-dimethyl ether
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H18O6
Net Charge0
Average Mass318.325
Monoisotopic Mass318.11034
SMILESCOc1ccc([C@H]2Oc3cc(O)cc(O)c3C[C@H]2O)cc1OC
InChIInChI=1S/C17H18O6/c1-21-14-4-3-9(5-16(14)22-2)17-13(20)8-11-12(19)6-10(18)7-15(11)23-17/h3-7,13,17-20H,8H2,1-2H3/t13-,17-/m1/s1
InChIKeyINGGXWWOTDZRPX-CXAGYDPISA-N
Species of MetaboliteComponentSourceComments
Cannabis sativa (ncbitaxon:3483) inflorescence (BTO:0000628) MetaboLights (MTBLS6032) Strain: Cannabis sativa var. DMG265
ChEBI Ontology
Outgoing Relation(s)
Epicatechin 3',4'-dimethyl ether (CHEBI:197156) is a catechin (CHEBI:23053)
IUPAC Name 
(2R,3R)-2-(3,4-dimethoxyphenyl)-3,4-dihydro-2H-chromene-3,5,7-triol
Manual XrefsDatabases
10395479ChemSpider
LMPK12020114LIPID MAPS