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CHEBI:208001 - Brasiliamide D

ChEBI IDCHEBI:208001
ChEBI NameBrasiliamide D
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SubmitterMetaboLights
DownloadsMolfile
FormulaC24H28N2O5
Net Charge0
Average Mass424.497
Monoisotopic Mass424.19982
SMILESCOc1cc(CC2CN(C(C)=O)[C@@H](Cc3ccccc3)CN2C(C)=O)cc2c1OCO2
InChIInChI=1S/C24H28N2O5/c1-16(27)25-14-21(10-19-11-22(29-3)24-23(12-19)30-15-31-24)26(17(2)28)13-20(25)9-18-7-5-4-6-8-18/h4-8,11-12,20-21H,9-10,13-15H2,1-3H3/t20-,21?/m0/s1
InChIKeyLGVCEIBVKNARBM-BGERDNNASA-N
Species of MetaboliteComponentSourceComments
Penicillium (ncbitaxon:5073) - PubMed (15118309)
ChEBI Ontology
Outgoing Relation(s)
Brasiliamide D (CHEBI:208001) is a benzodioxoles (CHEBI:38298)
IUPAC Name 
1-[(2S)-4-acetyl-2-benzyl-5-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl]ethanone
Manual XrefsDatabases
78437349ChemSpider