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CHEBI:201050 - Neovasipyridone A

ChEBI IDCHEBI:201050
ChEBI NameNeovasipyridone A
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SubmitterMetaboLights
DownloadsMolfile
FormulaC21H35NO3
Net Charge0
Average Mass349.515
Monoisotopic Mass349.26169
SMILESCCC(=O)C1=CN(CC(C)CC)C(/C(C)=C/C(C)CC)C(C)(O)C1=O
InChIInChI=1S/C21H35NO3/c1-8-14(4)11-16(6)19-21(7,25)20(24)17(18(23)10-3)13-22(19)12-15(5)9-2/h11,13-15,19,25H,8-10,12H2,1-7H3/b16-11+
InChIKeyNAMOYKKVUOAEJB-LFIBNONCSA-N
Species of MetaboliteComponentSourceComments
Fusarium neocosmosporiellum (ncbitaxon:1325723) - DOI (10.1016/0031-9422(95)00493-q)
ChEBI Ontology
Outgoing Relation(s)
Neovasipyridone A (CHEBI:201050) is a tetrahydropyridine (CHEBI:26921)
IUPAC Name 
3-hydroxy-3-methyl-1-(2-methylbutyl)-2-[(E)-4-methylhex-2-en-2-yl]-5-propanoyl-2H-pyridin-4-one
Manual XrefsDatabases
78444778ChemSpider