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CHEBI:217957 - Violaceimide B

ChEBI IDCHEBI:217957
ChEBI NameViolaceimide B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC13H19NO7S
Net Charge0
Average Mass333.362
Monoisotopic Mass333.08822
SMILESCOC(=O)[C@@H](CSC[C@H](O)C(=O)OC)N1C(=O)C[C@@H](C)C1=O
InChIInChI=1S/C13H19NO7S/c1-7-4-10(16)14(11(7)17)8(12(18)20-2)5-22-6-9(15)13(19)21-3/h7-9,15H,4-6H2,1-3H3/t7-,8-,9+/m1/s1
InChIKeyUVLQZEBULZTOAT-HLTSFMKQSA-N
Species of MetaboliteComponentSourceComments
Aspergillus violaceus (ncbitaxon:41738) - DOI (10.1016/j.tetlet.2018.05.085)
ChEBI Ontology
Outgoing Relation(s)
Violaceimide B (CHEBI:217957) is a α-amino acid ester (CHEBI:46874)
IUPAC Name 
methyl (2S)-3-[(2R)-2-hydroxy-3-methoxy-3-oxopropyl]sulanyl-2-[(3R)-3-methyl-2,5-dioxopyrrolidin-1-yl]propanoate
Manual XrefsDatabases
71048473ChemSpider