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CHEBI:217975 - Violaceimide E

ChEBI IDCHEBI:217975
ChEBI NameViolaceimide E
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H24N2O8S2
Net Charge0
Average Mass460.530
Monoisotopic Mass460.09741
SMILESCOC(=O)[C@@H](CSSC[C@H](C(=O)OC)N1C(=O)C[C@@H](C)C1=O)N1C(=O)C[C@@H](C)C1=O
InChIInChI=1S/C18H24N2O8S2/c1-9-5-13(21)19(15(9)23)11(17(25)27-3)7-29-30-8-12(18(26)28-4)20-14(22)6-10(2)16(20)24/h9-12H,5-8H2,1-4H3/t9-,10-,11-,12-/m1/s1
InChIKeyHRBIMIDVYGKICH-DDHJBXDOSA-N
Species of MetaboliteComponentSourceComments
Aspergillus violaceus (ncbitaxon:41738) - DOI (10.1016/j.tetlet.2018.05.085)
ChEBI Ontology
Outgoing Relation(s)
Violaceimide E (CHEBI:217975) is a α-amino acid ester (CHEBI:46874)
IUPAC Name 
methyl (2S)-3-[[(2S)-3-methoxy-2-[(3R)-3-methyl-2,5-dioxopyrrolidin-1-yl]-3-oxopropyl]disulanyl]-2-[(3R)-3-methyl-2,5-dioxopyrrolidin-1-yl]propanoate
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78439421ChemSpider