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CHEBI:192794 - β-alanyl-tryptaminium

ChEBI IDCHEBI:192794
ChEBI Nameβ-alanyl-tryptaminium
Stars
ASCII Namebeta-alanyl-tryptaminium
DefinitionA β-alanine derivative that is the amide obtained by formal condensation of the carboxy group of β-alanine with the primary amino group of tryptamine; major microspecies at pH 7.3.
SubmitterAnne Morgat
DownloadsMolfile
FormulaC13H18N3O
Net Charge+1
Average Mass232.307
Monoisotopic Mass232.14444
SMILES[NH3+]CCC(=O)NCCc1cnc2ccccc12
InChIInChI=1S/C13H17N3O/c14-7-5-13(17)15-8-6-10-9-16-12-4-2-1-3-11(10)12/h1-4,9,16H,5-8,14H2,(H,15,17)/p+1
InChIKeyANPPXRSQOVOACQ-UHFFFAOYSA-O
ChEBI Ontology
Outgoing Relation(s)
β-alanyl-tryptaminium (CHEBI:192794) is a tryptamines (CHEBI:27162)
β-alanyl-tryptaminium (CHEBI:192794) is a β-alanine derivative (CHEBI:22823)
UniProt Name  Source
β-alanyl-tryptamineUniProt
Citations