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CHEBI:175785 - (8R,8'R,9S)-9-Hydroxy-3,4-dimethoxy-3',4'-methylenoxy-9,9'-epoxylignan

ChEBI IDCHEBI:175785
ChEBI Name(8R,8'R,9S)-9-Hydroxy-3,4-dimethoxy-3',4'-methylenoxy-9,9'-epoxylignan
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC21H24O6
Net Charge0
Average Mass372.417
Monoisotopic Mass372.15729
SMILESCOc1ccc(CC2C(Cc3ccc4c(c3)OCO4)COC2O)cc1OC
InChIInChI=1S/C21H24O6/c1-23-17-5-3-14(9-19(17)24-2)8-16-15(11-25-21(16)22)7-13-4-6-18-20(10-13)27-12-26-18/h3-6,9-10,15-16,21-22H,7-8,11-12H2,1-2H3
InChIKeyFDXPFHFRXMBVEU-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
(8R,8'R,9S)-9-Hydroxy-3,4-dimethoxy-3',4'-methylenoxy-9,9'-epoxylignan (CHEBI:175785) is a lignan (CHEBI:25036)
IUPAC Name 
4-(1,3-benzodioxol-5-ylmethyl)-3-[(3,4-dimethoxyphenyl)methyl]oxolan-2-ol
Manual XrefsDatabases
HMDB0032733HMDB
35013477ChemSpider