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CHEBI:224027 - Penicimutatin

ChEBI IDCHEBI:224027
ChEBI NamePenicimutatin
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SubmitterMetaboLights
DownloadsMolfile
FormulaC25H27N3O2
Net Charge0
Average Mass401.510
Monoisotopic Mass401.21033
SMILESCC(C)=CCn1cc(C[C@@H]2NC(=O)[C@H](Cc3ccccc3)NC2=O)c2ccccc21
InChIInChI=1S/C25H27N3O2/c1-17(2)12-13-28-16-19(20-10-6-7-11-23(20)28)15-22-25(30)26-21(24(29)27-22)14-18-8-4-3-5-9-18/h3-12,16,21-22H,13-15H2,1-2H3,(H,26,30)(H,27,29)/t21-,22-/m0/s1
InChIKeyNYJNVRXNQRYYHW-VXKWHMMOSA-N
Species of MetaboliteComponentSourceComments
Talaromyces purpureogenus (ncbitaxon:1266744) - PubMed (24681631)
ChEBI Ontology
Outgoing Relation(s)
Penicimutatin (CHEBI:224027) is a indoles (CHEBI:24828)
IUPAC Name 
(3S,6S)-3-benzyl-6-[[1-(3-methylbut-2-enyl)indol-3-yl]methyl]piperazine-2,5-dione
Manual XrefsDatabases
32674976ChemSpider