CHEBI:8630 - pterostilbene

Main ChEBI Ontology Automatic Xrefs
ChEBI Name pterostilbene
ChEBI ID CHEBI:8630
Definition A stilbenol that consists of trans-stilbene bearing a hydroxy group at position 4 as well as two methoxy substituents at positions 3' and 5'.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C16H16O3
Net Charge 0
Average Mass 256.29640
InChI InChI=1S/C16H16O3/c1-18-15-9-13(10-16(11-15)19-2)4-3-12-5-7-14(17)8-6-12/h3-11,17H,1-2H3/b4-3+
InChIKey VLEUZFDZJKSGMX-ONEGZZNKSA-N
SMILES COc1cc(OC)cc(c1)\C=C\c1ccc(O)cc1
Metabolite of Species Details
Pterocarpus marsupium (IPNI:516505-1) Found in heartwood (PO:0004512). See: DOI
Vaccinium (NCBI:13749) Found in fruit (BTO:0000486). See: PubMed
Vitis vinifera (NCBI:29760) Found in leaf (BTO:0000713). See: PubMed
Vitis vinifera (NCBI:29760) Found in fruit (BTO:0000486). See: PubMed
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): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
neurotransmitter
An endogenous compound that is used to transmit information across the synapse between a neuron and another cell.
Application(s): antineoplastic agent
A substance that inhibits or prevents the proliferation of neoplasms.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing pterostilbene (CHEBI:8630) has parent hydride trans-stilbene (CHEBI:36007)
pterostilbene (CHEBI:8630) has role antineoplastic agent (CHEBI:35610)
pterostilbene (CHEBI:8630) has role antioxidant (CHEBI:22586)
pterostilbene (CHEBI:8630) has role metabolite (CHEBI:25212)
pterostilbene (CHEBI:8630) has role neurotransmitter (CHEBI:25512)
pterostilbene (CHEBI:8630) is a stilbenol (CHEBI:36027)
IUPAC Name
4-[(E)-2-(3,5-dimethoxyphenyl)ethenyl]phenol
Synonyms Sources
(E)-1-hydroxy-4-(3,5-dimethoxy)styrylbenzene ChEBI
(E)-3',5'-dimethoxy-4-stilbenol ChemIDplus
(E)-4'-hydroxy-3,5-dimethoxystilbene ChEBI
3',5'-dimethoxy-4-stilbenol ChemIDplus
3',5'-dimethoxy-resveratrol ChEBI
3,5-dimethoxy-4'-hydroxy-trans-stilbene ChEBI
4-(2-(3,5-Dimethoxyphenyl)ethenyl)phenol ChemIDplus
4-[(E)-2-(3,5-dimethoxyphenyl)vinyl]phenol IUPAC
pterostilbene UniProt
Pterostilbene KEGG COMPOUND
trans-pterostilbene ChEBI
Database Links Databases
C00002902 KNApSAcK
C10287 KEGG COMPOUND
CN101912377 Patent
CPD-6959 MetaCyc
EP2445488 Patent
KR20120000824 Patent
LMPK13090015 LIPID MAPS
Pterostilbene Wikipedia
US2011224290 Patent
View more database links
Registry Numbers Types Sources
2054316 Reaxys Registry Number Reaxys
537-42-8 CAS Registry Number ChemIDplus
Citations Waiting for Citations Types Sources
11312782 PubMed citation CiteXplore
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Last Modified
28 July 2014