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CHEBI:181817 - (3S)-3alpha-[1-(1,1-Dimethyl-2-propenyl)-1H-indole-3-ylmethyl]-6alpha-[2-(1,1-dimethyl-2-propenyl)-1H-indole-3-ylmethyl]piperazine-2,5-dione

ChEBI IDCHEBI:181817
ChEBI Name(3S)-3alpha-[1-(1,1-Dimethyl-2-propenyl)-1H-indole-3-ylmethyl]-6alpha-[2-(1,1-dimethyl-2-propenyl)-1H-indole-3-ylmethyl]piperazine-2,5-dione
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Last Modified4 November 2024
SubmitterMetaboLights
DownloadsMolfile
FormulaC32H36N4O2
Net Charge0
Average Mass508.666
Monoisotopic Mass508.28383
SMILESC=CC(C)(C)c1nc2ccccc2c1C[C@@H]1NC(=O)[C@H](Cc2cn(C(C)(C)C=C)c3ccccc23)NC1=O
InChIInChI=1S/C32H36N4O2/c1-7-31(3,4)28-23(22-14-9-11-15-24(22)33-28)18-26-30(38)34-25(29(37)35-26)17-20-19-36(32(5,6)8-2)27-16-12-10-13-21(20)27/h7-16,19,25-26,33H,1-2,17-18H2,3-6H3,(H,34,38)(H,35,37)/t25-,26-/m0/s1
InChIKeyCSKRCVQJKJFWGN-UIOOFZCWSA-N
ChEBI Ontology
Outgoing Relation(s)
(3S)-3alpha-[1-(1,1-Dimethyl-2-propenyl)-1H-indole-3-ylmethyl]-6alpha-[2-(1,1-dimethyl-2-propenyl)-1H-indole-3-ylmethyl]piperazine-2,5-dione (CHEBI:181817) is a indoles (CHEBI:24828)
IUPAC Name 
(3S,6S)-3-[[1-(2-methylbut-3-en-2-yl)indol-3-yl]methyl]-6-[[2-(2-methylbut-3-en-2-yl)-1H-indol-3-yl]methyl]piperazine-2,5-dione
UniProt Name  Source
cyclo(N8-(α,α-dimethylallyl)-L-Trp-6a-(α,α-dimethylallyl)-L-Trp)UniProt