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CHEBI:223313 - Scalusamide B

ChEBI IDCHEBI:223313
ChEBI NameScalusamide B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H27NO3
Net Charge0
Average Mass281.396
Monoisotopic Mass281.19909
SMILESCCC/C=C/CCC(=O)C(C)C(=O)N1CCC[C@@H]1CO
InChIInChI=1S/C16H27NO3/c1-3-4-5-6-7-10-15(19)13(2)16(20)17-11-8-9-14(17)12-18/h5-6,13-14,18H,3-4,7-12H2,1-2H3/b6-5+/t13?,14-/m1/s1
InChIKeyHFWMLSNVDWMIEV-GCWZKKBRSA-N
Species of MetaboliteComponentSourceComments
Penicillium citrinum (ncbitaxon:5077) - PubMed (15730261)
ChEBI Ontology
Outgoing Relation(s)
Scalusamide B (CHEBI:223313) is a N-acylpyrrolidine (CHEBI:46766)
IUPAC Name 
(E)-1-[(2R)-2-(hydroxymethyl)pyrrolidin-1-yl]-2-methyldec-6-ene-1,3-dione
Manual XrefsDatabases
9394816ChemSpider