CHEBI:76143 - (2R,3S)-trans-ε-viniferin

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name (2R,3S)-trans-ε-viniferin
ChEBI ID CHEBI:76143
ChEBI ASCII Name (2R,3S)-trans-epsilon-viniferin
Definition A stilbenoid that is the (2R,3S)-trans-stereoisomer of ε-viniferin, obtained by cyclodimerisation of trans-resveratrol.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C28H22O6
Net Charge 0
Average Mass 454.47070
Monoisotopic Mass 454.14164
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-/m0/s1
InChIKey FQWLMRXWKZGLFI-PAKBJIOWSA-N
SMILES Oc1ccc(\C=C\c2cc(O)cc3O[C@H]([C@H](c23)c2cc(O)cc(O)c2)c2ccc(O)cc2)cc1
ChEBI Ontology
Outgoing (2R,3S)-trans-ε-viniferin (CHEBI:76143) has functional parent trans-resveratrol (CHEBI:45713)
(2R,3S)-trans-ε-viniferin (CHEBI:76143) is a 1-benzofurans (CHEBI:38830)
(2R,3S)-trans-ε-viniferin (CHEBI:76143) is a polyphenol (CHEBI:26195)
(2R,3S)-trans-ε-viniferin (CHEBI:76143) is a stilbenoid (CHEBI:26776)
(2R,3S)-trans-ε-viniferin (CHEBI:76143) is enantiomer of (2S,3R)-trans-ε-viniferin (CHEBI:76140)
Incoming (2S,3R)-trans-ε-viniferin (CHEBI:76140) is enantiomer of (2R,3S)-trans-ε-viniferin (CHEBI:76143)
IUPAC Name
5-{(2R,3S)-6-hydroxy-2-(4-hydroxyphenyl)-4-[(E)-2-(4-hydroxyphenyl)ethenyl]-2,3-dihydro-1-benzofuran-3-yl}benzene-1,3-diol
Registry Number Type Source
5172828 Reaxys Registry Number Reaxys
Last Modified
05 December 2013