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CHEBI:225175 - Pestalotiopamide C

ChEBI IDCHEBI:225175
ChEBI NamePestalotiopamide C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC13H21NO5
Net Charge0
Average Mass271.313
Monoisotopic Mass271.14197
SMILESCOC(=O)CCCNC(=O)/C=C(\C)CCOC(C)=O
InChIInChI=1S/C13H21NO5/c1-10(6-8-19-11(2)15)9-12(16)14-7-4-5-13(17)18-3/h9H,4-8H2,1-3H3,(H,14,16)/b10-9+
InChIKeyYJAKSKSMUOXRHW-MDZDMXLPSA-N
Species of MetaboliteComponentSourceComments
Pestalotiopsisspecies (ncbitaxon:36460) - DOI (10.1016/j.tetlet.2010.10.131)
ChEBI Ontology
Outgoing Relation(s)
Pestalotiopamide C (CHEBI:225175) has functional parent γ-amino acid (CHEBI:33707)
Pestalotiopamide C (CHEBI:225175) is a organonitrogen compound (CHEBI:35352)
Pestalotiopamide C (CHEBI:225175) is a organooxygen compound (CHEBI:36963)
IUPAC Name 
methyl 4-[[(E)-5-acetyloxy-3-methylpent-2-enoyl]amino]butanoate
Manual XrefsDatabases
27026314ChemSpider