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CHEBI:212360 - A26771E

ChEBI IDCHEBI:212360
ChEBI NameA26771E
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FormulaC16H22N2O3S2
Net Charge0
Average Mass354.497
Monoisotopic Mass354.10718
SMILESCSC1(CO)C(=O)N(C)C(Cc2ccccc2)(SC)C(=O)N1C
InChIInChI=1S/C16H22N2O3S2/c1-17-14(21)16(11-19,23-4)18(2)13(20)15(17,22-3)10-12-8-6-5-7-9-12/h5-9,19H,10-11H2,1-4H3
InChIKeyWXIJHVRXTHDGKV-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Penicillium turbatum (ncbitaxon:70105) - PubMed (4367201)
ChEBI Ontology
Outgoing Relation(s)
A26771E (CHEBI:212360) has functional parent α-amino acid (CHEBI:33704)
A26771E (CHEBI:212360) is a organonitrogen compound (CHEBI:35352)
A26771E (CHEBI:212360) is a organooxygen compound (CHEBI:36963)
IUPAC Name 
3-benzyl-6-(hydroxymethyl)-1,4-dimethyl-3,6-bis(methylsulanyl)piperazine-2,5-dione
Manual XrefsDatabases
149399ChemSpider