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CHEBI:66799 - 6-(2-Pyrrolidinone-5-yl)-(-)-epicatechin

ChEBI IDCHEBI:66799
ChEBI Name6-(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)cc3c(c2O)C[C@@H](O)[C@@H](c2ccc(O)c(O)c2)O3)N1
InChIInChI=1S/C19H19NO7/c21-11-3-1-8(5-12(11)22)19-14(24)6-9-15(27-19)7-13(23)17(18(9)26)10-2-4-16(25)20-10/h1,3,5,7,10,14,19,21-24,26H,2,4,6H2,(H,20,25)/t10?,14-,19-/m1/s1
InChIKeyUCIRBQYYKCLWFF-SEKYPHQKSA-N
Species of MetaboliteComponentSourceComments
Actinidia arguta (ncbitaxon:64478) root (BTO:0001188) PubMed (19336935) 5:3 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)
6-(2-Pyrrolidinone-5-yl)-(-)-epicatechin (CHEBI:66799) has role metabolite (CHEBI:25212)
6-(2-Pyrrolidinone-5-yl)-(-)-epicatechin (CHEBI:66799) is a catechin (CHEBI:23053)
Citations