CHEBI:76193 - (E)-trans-miyabenol C

Main ChEBI Ontology Automatic Xrefs
ChEBI Name (E)-trans-miyabenol C
ChEBI ID CHEBI:76193
ChEBI ASCII Name (E)-trans-miyabenol C
Definition A benzofuran-derived stilbenoid that is a homotrimer obtained by cyclotrimerisation of resveratrol.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C42H32O9
Net Charge 0
Average Mass 680.69810
InChI InChI=1S/C42H32O9/c43-27-9-2-22(3-10-27)1-4-25-15-32(48)20-35-37(25)40(42(50-35)24-7-13-29(45)14-8-24)34-19-33(49)21-36-39(34)38(26-16-30(46)18-31(47)17-26)41(51-36)23-5-11-28(44)12-6-23/h1-21,38,40-49H/b4-1+/t38-,40+,41+,42-/m1/s1
InChIKey RKFYYCKIHVEWHX-YOBICRQBSA-N
SMILES Oc1ccc(\C=C\c2cc(O)cc3O[C@@H]([C@H](c23)c2cc(O)cc3O[C@H]([C@@H](c23)c2cc(O)cc(O)c2)c2ccc(O)cc2)c2ccc(O)cc2)cc1
Roles Classification
Chemical Role(s): antioxidant
A substance that opposes oxidation or inhibits reactions brought about by dioxygen or peroxides. In European countries, E-numbers for permitted antioxidant food additives are from E 300 to E 324.
Biological Role(s): plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
serotonergic antagonist
Drugs that bind to but do not activate serotonin receptors, thereby blocking the actions of serotonin or serotonergic agonists.
apoptosis inducer
Any substance that induces the process of apoptosis (programmed cell death) in multi-celled organisms.
EC 2.7.11.13 (protein kinase C) inhibitor
An EC 2.7.11.* (protein-serine/threonine kinase) inhibitor that interferes with the action of protein kinase C (EC 2.7.11.13).
Application(s): serotonergic antagonist
Drugs that bind to but do not activate serotonin receptors, thereby blocking the actions of serotonin or serotonergic agonists.
antineoplastic agent
A substance that inhibits or prevents the proliferation of neoplasms.
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ChEBI Ontology
Outgoing (E)-trans-miyabenol C (CHEBI:76193) has functional parent trans-resveratrol (CHEBI:45713)
(E)-trans-miyabenol C (CHEBI:76193) has role antineoplastic agent (CHEBI:35610)
(E)-trans-miyabenol C (CHEBI:76193) has role antioxidant (CHEBI:22586)
(E)-trans-miyabenol C (CHEBI:76193) has role apoptosis inducer (CHEBI:68495)
(E)-trans-miyabenol C (CHEBI:76193) has role EC 2.7.11.13 (protein kinase C) inhibitor (CHEBI:37700)
(E)-trans-miyabenol C (CHEBI:76193) has role plant metabolite (CHEBI:76924)
(E)-trans-miyabenol C (CHEBI:76193) has role serotonergic antagonist (CHEBI:48279)
(E)-trans-miyabenol C (CHEBI:76193) is a 1-benzofurans (CHEBI:38830)
(E)-trans-miyabenol C (CHEBI:76193) is a polyphenol (CHEBI:26195)
(E)-trans-miyabenol C (CHEBI:76193) is a stilbenoid (CHEBI:26776)
IUPAC Name
(2S,2'R,3S,3'R)-3'-(3,5-dihydroxyphenyl)-2,2'-bis(4-hydroxyphenyl)-4-[(E)-2-(4-hydroxyphenyl)ethenyl]-2,2',3,3'-tetrahydro-3,4'-bi-1-benzofuran-6,6'-diol
Synonyms Sources
(+)-trans-miyabenol C ChEBI
miyabenol C ChEBI
trans-miyabenol C ChEBI
Database Links Databases
EP0998924 Patent
Miyabenol_C Wikipedia
WO9904776 Patent
View more database links
Registry Number Type Source
4777735 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
12518232 PubMed citation CiteXplore
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21761862 PubMed citation CiteXplore
22209460 PubMed citation CiteXplore
23145924 PubMed citation CiteXplore
23157192 PubMed citation CiteXplore
23270496 PubMed citation CiteXplore
24456249 PubMed citation CiteXplore
380052 Chinese Abstracts citation CiteXplore
7700990 PubMed citation CiteXplore
Last Modified
19 February 2014