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CHEBI:172730 - Divanillyltetrahydrofuran ferulate

ChEBI IDCHEBI:172730
ChEBI NameDivanillyltetrahydrofuran ferulate
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC30H32O8
Net Charge0
Average Mass520.578
Monoisotopic Mass520.20972
SMILESCOc1cc(/C=C/C(=O)Oc2ccc(CC3COCC3Cc3ccc(O)c(OC)c3)cc2OC)ccc1O
InChIInChI=1S/C30H32O8/c1-34-27-14-19(4-8-24(27)31)7-11-30(33)38-26-10-6-21(16-29(26)36-3)13-23-18-37-17-22(23)12-20-5-9-25(32)28(15-20)35-2/h4-11,14-16,22-23,31-32H,12-13,17-18H2,1-3H3/b11-7+
InChIKeyWUMFMXNTYLFVSJ-YRNVUSSQSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) blood plasma (BTO:0000131) MetaboLights (MTBLS2633)
ChEBI Ontology
Outgoing Relation(s)
Divanillyltetrahydrofuran ferulate (CHEBI:172730) is a lignan (CHEBI:25036)
IUPAC Name 
[4-[[4-[(4-hydroxy-3-methoxyphenyl)methyl]oxolan-3-yl]methyl]-2-methoxyphenyl] (E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate
Manual XrefsDatabases
35013475ChemSpider
HMDB0032730HMDB