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CHEBI:224311 - SCH-56396

ChEBI IDCHEBI:224311
ChEBI NameSCH-56396
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SubmitterMetaboLights
DownloadsMolfile
FormulaC17H20N2O3S
Net Charge0
Average Mass332.425
Monoisotopic Mass332.11946
SMILESCS[C@@H]1NC(=O)/C(=C/c2ccc(OCC=C(C)C)cc2)NC1=O
InChIInChI=1S/C17H20N2O3S/c1-11(2)8-9-22-13-6-4-12(5-7-13)10-14-15(20)19-17(23-3)16(21)18-14/h4-8,10,17H,9H2,1-3H3,(H,18,21)(H,19,20)/b14-10-/t17-/m0/s1
InChIKeyDFTITSOGUUDLJM-QXSWTLKVSA-N
Species of MetaboliteComponentSourceComments
Tolypocladiumspecies (ncbitaxon:1856741) - PubMed (9510915)
ChEBI Ontology
Outgoing Relation(s)
SCH-56396 (CHEBI:224311) has functional parent α-amino acid (CHEBI:33704)
SCH-56396 (CHEBI:224311) is a organonitrogen compound (CHEBI:35352)
SCH-56396 (CHEBI:224311) is a organooxygen compound (CHEBI:36963)
IUPAC Name 
(3Z)-3-[[4-(3-methylbut-2-enoxy)phenyl]methylidene]-6-methylsulanylpiperazine-2,5-dione
Manual XrefsDatabases
8195241ChemSpider