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CHEBI:157735 - Pyrrolidine, 1-(m-methoxycinnamoyl)-

ChEBI IDCHEBI:157735
ChEBI NamePyrrolidine, 1-(m-methoxycinnamoyl)-
Stars
Last Modified24 July 2024
SubmitterMetaboLights
DownloadsMolfile
FormulaC14H17NO2
Net Charge0
Average Mass231.295
Monoisotopic Mass231.12593
SMILESCOc1cccc(/C=C/C(=O)N2CCCC2)c1
InChIInChI=1S/C14H17NO2/c1-17-13-6-4-5-12(11-13)7-8-14(16)15-9-2-3-10-15/h4-8,11H,2-3,9-10H2,1H3/b8-7+
InChIKeyLAPTWLCIZWFMJK-BQYQJAHWSA-N
Species of MetaboliteComponentSourceComments
Piper methysticum (ncbitaxon:130404)
crown root (PO:0000043) MetaboLights (MTBLS1485) Strain: Piper methysticum cv. Loa Kasa Leka
stem (BTO:0001300) MetaboLights (MTBLS1485) Strain: Piper methysticum cv. Loa Kasa Leka
lateral root (BTO:0005441) MetaboLights (MTBLS1485) Strain: Piper methysticum cv. Loa Kasa Leka
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
Pyrrolidine, 1-(m-methoxycinnamoyl)- (CHEBI:157735) is a hydroxycinnamic acid (CHEBI:24689)
IUPAC Name 
(E)-3-(3-methoxyphenyl)-1-pyrrolidin-1-ylprop-2-en-1-one
Manual XrefsDatabases
4523676ChemSpider
HMDB0038839HMDB