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CHEBI:70254 - 3'-O-methylepicatechin

ChEBI IDCHEBI:70254
ChEBI Name3'-O-methylepicatechin
Stars
DefinitionA natural product found in Parapiptadenia rigida.
Last Modified22 September 2014
DownloadsMolfile
FormulaC16H16O6
Net Charge0
Average Mass304.298
Monoisotopic Mass304.09469
SMILESCOc1cc([C@H]2Oc3cc(O)cc(O)c3C[C@H]2O)ccc1O
InChIInChI=1S/C16H16O6/c1-21-15-4-8(2-3-11(15)18)16-13(20)7-10-12(19)5-9(17)6-14(10)22-16/h2-6,13,16-20H,7H2,1H3/t13-,16-/m1/s1
InChIKeyNJHJXXLBWQXMRO-CZUORRHYSA-N
Species of MetaboliteComponentSourceComments
Parapiptadenia rigida (ncbitaxon:148713) bark (BTO:0001301) PubMed (21080642) Ethanolic extract of air-dried, powdered bark
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)
3'-O-methylepicatechin (CHEBI:70254) has role metabolite (CHEBI:25212)
3'-O-methylepicatechin (CHEBI:70254) is a catechin (CHEBI:23053)
Synonyms  Source
(2R,3R)-2-(4-hydroxy-3-methoxyphenyl)-3,4-dihydro-2H-chromene-3,5,7-triolChEBI
SymplocosidinChEBI
Manual XrefsDatabases
HMDB0029175HMDB
Citations