CHEBI:10556 - (−)-trans-ε-viniferin

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ChEBI Name (−)-trans-ε-viniferin
ChEBI ID CHEBI:10556
ChEBI ASCII Name (-)-trans-epsilon-viniferin
Definition A stilbenoid that is the (−)-trans-stereoisomer of ε-viniferin, obtained by cyclodimerisation of trans-resveratrol.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C28H22O6
Net Charge 0
Average Mass 454.47070
Monoisotopic Mass 454.142
InChI InChI=1S/C28H22O6/c29-20-7-2-16(3-8-20)1-4-18-11-24(33)15-25-26(18)27(19-12-22(31)14-23(32)13-19)28(34-25)17-5-9-21(30)10-6-17/h1-15,27-33H/b4-1+/t27-,28+/m1/s1
InChIKey FQWLMRXWKZGLFI-YVYUXZJTSA-N
SMILES Oc1ccc(\C=C\c2cc(O)cc3O[C@H]([C@@H](c23)c2cc(O)cc(O)c2)c2ccc(O)cc2)cc1
Roles Classification
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
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ChEBI Ontology
Outgoing (−)-trans-ε-viniferin (CHEBI:10556) has functional parent trans-resveratrol (CHEBI:45713)
(−)-trans-ε-viniferin (CHEBI:10556) has role metabolite (CHEBI:25212)
(−)-trans-ε-viniferin (CHEBI:10556) is a 1-benzofurans (CHEBI:38830)
(−)-trans-ε-viniferin (CHEBI:10556) is a polyphenol (CHEBI:26195)
(−)-trans-ε-viniferin (CHEBI:10556) is a stilbenoid (CHEBI:26776)
(−)-trans-ε-viniferin (CHEBI:10556) is enantiomer of (+)-trans-ε-viniferin (CHEBI:76137)
Incoming (+)-trans-ε-viniferin (CHEBI:76137) is enantiomer of (−)-trans-ε-viniferin (CHEBI:10556)
IUPAC Name
5-{(2R,3R)-6-hydroxy-2-(4-hydroxyphenyl)-4-[(E)-2-(4-hydroxyphenyl)ethenyl]-2,3-dihydro-1-benzofuran-3-yl}benzene-1,3-diol
Synonym Source
epsilon-Viniferin KEGG COMPOUND
Manual Xrefs Databases
C00002905 KNApSAcK
C10289 KEGG COMPOUND
Epsilon-viniferin Wikipedia
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Registry Numbers Types Sources
4278292 Reaxys Registry Number Reaxys
62218-08-0 CAS Registry Number ChemIDplus
Last Modified
28 July 2014