CHEBI:45713 - trans-resveratrol

ChEBI IDCHEBI:45713
ChEBI Nametrans-resveratrol
Stars
ASCII Nametrans-resveratrol
DefinitionA resveratrol in which the double bond has E configuration.
Secondary ChEBI IDsCHEBI:36000, CHEBI:45712
Last Modified10 November 2017
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC14H12O3
Net Charge0
Average Mass228.247
Monoisotopic Mass228.07864
SMILESOc1ccc(/C=C/c2cc(O)cc(O)c2)cc1
InChIInChI=1S/C14H12O3/c15-12-5-3-10(4-6-12)1-2-11-7-13(16)9-14(17)8-11/h1-9,15-17H/b2-1+
InChIKeyLUKBXSAWLPMMSZ-OWOJBTEDSA-N
Wikipedia
Species of MetaboliteComponentSourceComments
Arachis hypogaea (ncbitaxon:3818) seed (BTO:0001226) PubMed (21348467)
Vitis vinifera (ncbitaxon:29760) - PubMed (11408943)
Roles Classification
Chemical Roles:
radical scavenger  A role played by a substance that can react readily with, and thereby eliminate, radicals.
antioxidant  A substance that opposes oxidation or inhibits reactions brought about by dioxygen or peroxides.
antioxidant  A substance that opposes oxidation or inhibits reactions brought about by dioxygen or peroxides.
Biological Roles:
quorum sensing inhibitor  Any compound that interferes with bacterial communication (quorum sensing, QS).
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
phytoalexin  A toxin made by a plant that acts against an organism attacking it.
glioma-associated oncogene inhibitor  An inhibitor of any of the glioma-associated oncogene (GLI) proteins.
phytoalexin  A toxin made by a plant that acts against an organism attacking it.
Application:
geroprotector  Any compound that supports healthy aging, slows the biological aging process, or extends lifespan.
ChEBI Ontology
Outgoing Relation(s)
trans-resveratrol (CHEBI:45713) has role antioxidant (CHEBI:22586)
trans-resveratrol (CHEBI:45713) has role phytoalexin (CHEBI:26115)
trans-resveratrol (CHEBI:45713) has role plant metabolite (CHEBI:76924)
trans-resveratrol (CHEBI:45713) has role quorum sensing inhibitor (CHEBI:138977)
trans-resveratrol (CHEBI:45713) has role radical scavenger (CHEBI:48578)
trans-resveratrol (CHEBI:45713) is a resveratrol (CHEBI:27881)
Incoming Relation(s)
(+)-trans-ε-viniferin (CHEBI:76137) has functional parent trans-resveratrol (CHEBI:45713)
(E)-trans-miyabenol C (CHEBI:76193) has functional parent trans-resveratrol (CHEBI:45713)
(−)-trans-ε-viniferin (CHEBI:10556) has functional parent trans-resveratrol (CHEBI:45713)
(2R,3R)-trans-δ-viniferin (CHEBI:76147) has functional parent trans-resveratrol (CHEBI:45713)
(2R,3S)-trans-ε-viniferin (CHEBI:76143) has functional parent trans-resveratrol (CHEBI:45713)
(2S,3R)-trans-ε-viniferin (CHEBI:76140) has functional parent trans-resveratrol (CHEBI:45713)
(2S,3S)-trans-δ-viniferin (CHEBI:76141) has functional parent trans-resveratrol (CHEBI:45713)
trans-diptoindonesin B (CHEBI:76196) has functional parent trans-resveratrol (CHEBI:45713)
trans-piceid (CHEBI:8198) has functional parent trans-resveratrol (CHEBI:45713)
3-methoxy-4',5-dihydroxy-trans-stilbene (CHEBI:63672) has functional parent trans-resveratrol (CHEBI:45713)
4'-O-methyl-trans-resveratrol (CHEBI:232084) has functional parent trans-resveratrol (CHEBI:45713)
resveratrol-3-O-sulfate (CHEBI:84040) has functional parent trans-resveratrol (CHEBI:45713)
IUPAC Name 
5-[(1E)-2-(4-hydroxyphenyl)ethenyl]benzene-1,3-diol
Synonyms  Source
5-[(E)-2-(4-hydroxyphenyl)vinyl]benzene-1,3-diolPDBeChem
(E)-5-(2-(4-hydroxyphenyl)ethenyl)-1,3-benzenediolChemIDplus
RESVERATROLPDBeChem
3,4',5-trihydroxystilbeneChemIDplus
3,5,4'-trihydroxystilbeneChemIDplus
3,4',5-stilbenetriolChemIDplus
UniProt Name  Source
trans-resveratrolUniProt
Manual XrefsDatabases
STLPDBeChem
ResveratrolWikipedia
C03582KEGG COMPOUND
C00002903KNApSAcK
HMDB0003747HMDB
LMPK13090005LIPID MAPS
CPD-83MetaCyc
DB02709DrugBank
Registry NumbersSources
Beilstein:1912434Beilstein
Reaxys:1912434Reaxys
CAS:501-36-0ChemIDplus
CAS:501-36-0KEGG COMPOUND
CAS:501-36-0NIST Chemistry WebBook
Citations