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CHEBI:224457 - PJ157

ChEBI IDCHEBI:224457
ChEBI NamePJ157
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SubmitterMetaboLights
DownloadsMolfile
FormulaC22H28N2O3
Net Charge0
Average Mass368.477
Monoisotopic Mass368.20999
SMILESCC(C)=CCC/C(C)=C/COc1ccc(/C=C2/NC(=O)[C@H](C)NC2=O)cc1
InChIInChI=1S/C22H28N2O3/c1-15(2)6-5-7-16(3)12-13-27-19-10-8-18(9-11-19)14-20-22(26)23-17(4)21(25)24-20/h6,8-12,14,17H,5,7,13H2,1-4H3,(H,23,26)(H,24,25)/b16-12+,20-14+/t17-/m0/s1
InChIKeyWJYQOEOGXGQMEU-MSODBRDKSA-N
Species of MetaboliteComponentSourceComments
Gliocladium (ncbitaxon:62887) - PubMed (17566910)
ChEBI Ontology
Outgoing Relation(s)
PJ157 (CHEBI:224457) is a monoterpenoid (CHEBI:25409)
IUPAC Name 
(3E,6S)-3-[[4-[(2E)-3,7-dimethylocta-2,6-dienoxy]phenyl]methylidene]-6-methylpiperazine-2,5-dione
Manual XrefsDatabases
23076639ChemSpider