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CHEBI:145680 - (+)-isomalbrancheamide C(1+)

Default Structure
ChEBI IDCHEBI:145680
ChEBI Name(+)-isomalbrancheamide C(1+)
Stars
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC21H25BrN3O
Net Charge+1
Average Mass415.355
Monoisotopic Mass414.11755
SMILES[H][C@@]12C[C@]34CCC[NH+]3C[C@@]1(Cc1c(nc3ccc(Br)cc13)C2(C)C)NC4=O
InChIInChI=1S/C21H24BrN3O/c1-19(2)16-10-21-6-3-7-25(21)11-20(16,24-18(21)26)9-14-13-8-12(22)4-5-15(13)23-17(14)19/h4-5,8,16,23H,3,6-7,9-11H2,1-2H3,(H,24,26)/p+1/t16-,20+,21-/m0/s1
InChIKeyNPJZWUULBVDKRA-DQLDELGASA-O
ChEBI Ontology
Outgoing Relation(s)
(+)-isomalbrancheamide C(1+) (CHEBI:145680) is a organic molecular entity (CHEBI:50860)
UniProt Name  Source
(+)-isomalbrancheamide CUniProt
Citations