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CHEBI:181964 - (E)-N-(4-Acetamidobutyl)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enamide

ChEBI IDCHEBI:181964
ChEBI Name(E)-N-(4-Acetamidobutyl)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enamide
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H22N2O4
Net Charge0
Average Mass306.362
Monoisotopic Mass306.15796
SMILESCOc1cc(/C=C/C(=O)NCCCCNC(C)=O)ccc1O
InChIInChI=1S/C16H22N2O4/c1-12(19)17-9-3-4-10-18-16(21)8-6-13-5-7-14(20)15(11-13)22-2/h5-8,11,20H,3-4,9-10H2,1-2H3,(H,17,19)(H,18,21)/b8-6+
InChIKeyZVMGKOAHBAIHLO-SOFGYWHQSA-N
Species of MetaboliteComponentSourceComments
Bombus terrestris (ncbitaxon:30195)
hemolymph (BTO:0000572) MetaboLights (MTBLS3637)
brain (BTO:0000142) MetaboLights (MTBLS3637)
hindgut (BTO:0000510) MetaboLights (MTBLS3637)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
(E)-N-(4-Acetamidobutyl)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enamide (CHEBI:181964) is a hydroxycinnamic acid (CHEBI:24689)
IUPAC Name 
(E)-N-(4-acetamidobutyl)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enamide
Manual XrefsDatabases
22913014ChemSpider