EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:70085 - 3-(4-hydroxy-3,5-dimethoxyphenyl)propanoylpyrrole

ChEBI IDCHEBI:70085
ChEBI Name3-(4-hydroxy-3,5-dimethoxyphenyl)propanoylpyrrole
Stars
DefinitionA natural product found in Piper boehmeriaefolium.
Last Modified22 September 2014
DownloadsMolfile
FormulaC15H17NO4
Net Charge0
Average Mass275.304
Monoisotopic Mass275.11576
SMILESCOc1cc(CCC(=O)n2cccc2)cc(OC)c1O
InChIInChI=1S/C15H17NO4/c1-19-12-9-11(10-13(20-2)15(12)18)5-6-14(17)16-7-3-4-8-16/h3-4,7-10,18H,5-6H2,1-2H3
InChIKeyLTAWLNXRMOAJDO-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Piper boehmeriaefolium (ncbitaxon:130389) whole plant (BTO:0001461) PubMed (21158422) Methanolic extract of air-dried, powdered whole plant
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-(4-hydroxy-3,5-dimethoxyphenyl)propanoylpyrrole (CHEBI:70085) has role metabolite (CHEBI:25212)
3-(4-hydroxy-3,5-dimethoxyphenyl)propanoylpyrrole (CHEBI:70085) is a methoxybenzenes (CHEBI:51683)
3-(4-hydroxy-3,5-dimethoxyphenyl)propanoylpyrrole (CHEBI:70085) is a phenols (CHEBI:33853)
Citations