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CHEBI:217697 - Brocaeloid B

ChEBI IDCHEBI:217697
ChEBI NameBrocaeloid B
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SubmitterMetaboLights
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FormulaC17H22N2O3
Net Charge0
Average Mass302.374
Monoisotopic Mass302.16304
SMILESC=CC(C)(C)C(=O)Nc1ccccc1C(=O)CCNC(C)=O
InChIInChI=1S/C17H22N2O3/c1-5-17(3,4)16(22)19-14-9-7-6-8-13(14)15(21)10-11-18-12(2)20/h5-9H,1,10-11H2,2-4H3,(H,18,20)(H,19,22)
InChIKeyFROOGKVRWMYTPK-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Penicillium (ncbitaxon:5073) - DOI (10.1002/ejoc.201400067)
ChEBI Ontology
Outgoing Relation(s)
Brocaeloid B (CHEBI:217697) is a aromatic ketone (CHEBI:76224)
IUPAC Name 
N-[2-(3-acetamidopropanoyl)phenyl]-2,2-dimethylbut-3-enamide
Manual XrefsDatabases
34981948ChemSpider