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CHEBI:66800 - 8-(2-Pyrrolidinone-5-yl)-(-)-epicatechin

ChEBI IDCHEBI:66800
ChEBI Name8-(2-Pyrrolidinone-5-yl)-(-)-epicatechin
Stars
DefinitionA natural product found in Actinidia arguta.
Last Modified22 September 2014
DownloadsMolfile
FormulaC19H19NO7
Net Charge0
Average Mass373.361
Monoisotopic Mass373.11615
SMILESO=C1CCC(c2c(O)cc(O)c3c2O[C@H](c2ccc(O)c(O)c2)[C@H](O)C3)N1
InChIInChI=1S/C19H19NO7/c21-11-3-1-8(5-13(11)23)18-15(25)6-9-12(22)7-14(24)17(19(9)27-18)10-2-4-16(26)20-10/h1,3,5,7,10,15,18,21-25H,2,4,6H2,(H,20,26)/t10?,15-,18-/m1/s1
InChIKeyZGIKMQJUZZSYOY-PHSFOTSCSA-N
Species of MetaboliteComponentSourceComments
Actinidia arguta (ncbitaxon:64478) root (BTO:0001188) PubMed (19336935) 2:1 diastereomeric mixture
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
8-(2-Pyrrolidinone-5-yl)-(-)-epicatechin (CHEBI:66800) has role metabolite (CHEBI:25212)
8-(2-Pyrrolidinone-5-yl)-(-)-epicatechin (CHEBI:66800) is a catechin (CHEBI:23053)
Citations