CHEBI:70254 - 3'-O-methylepicatechin

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ChEBI Name 3'-O-methylepicatechin
ChEBI ID CHEBI:70254
Definition A natural product found in Parapiptadenia rigida.
Stars This entity has been manually annotated by a third party.
Supplier Information eMolecules:591716, ZINC000000057152
Download Molfile XML SDF
Formula C16H16O6
Net Charge 0
Average Mass 304.29460
Monoisotopic Mass 304.09469
InChI InChI=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
InChIKey NJHJXXLBWQXMRO-CZUORRHYSA-N
SMILES COc1cc(ccc1O)[C@H]1Oc2cc(O)cc(O)c2C[C@H]1O
Metabolite of Species Details
Parapiptadenia rigida (NCBI:txid148713) Found in bark (BTO:0001301). Ethanolic extract of air-dried, powdered bark See: PubMed
Roles Classification
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 3'-O-methylepicatechin (CHEBI:70254) has role metabolite (CHEBI:25212)
3'-O-methylepicatechin (CHEBI:70254) is a catechin (CHEBI:23053)
Synonyms Sources
(2R,3R)-2-(4-hydroxy-3-methoxyphenyl)-3,4-dihydro-2H-chromene-3,5,7-triol ChEBI
Symplocosidin ChEBI
Manual Xref Database
HMDB0029175 HMDB
View more database links
Citation Type Source
21080642 PubMed citation Europe PMC
Last Modified
22 September 2014
General Comment
2014-10-17 Suggested Classification: ISA:flavonoids(CHEBI:72544); ISA:ether(CHEBI:25698); ISA:hydroxyflavonoid(CHEBI:71968); ISA:1-benzopyran(CHEBI:38443); ISA:phenols(CHEBI:33853); ISA:methoxybenzene(CHEBI:51683); ISA:resorcinols(CHEBI:33572); ISA:aromatic ether(CHEBI:35618); ISA:secondary alcohol(CHEBI:35681); ISA:polyol(CHEBI:26191); ISA:aromatic alcohol(CHEBI:33854);