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CHEBI:215285 - Metatacarboline A

ChEBI IDCHEBI:215285
ChEBI NameMetatacarboline A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H19N3O5
Net Charge0
Average Mass381.388
Monoisotopic Mass381.13247
SMILESO=C(O)c1cc2c(nc3ccccc32)c(CCC(=O)N2CCC[C@H]2C(=O)O)n1
InChIInChI=1S/C20H19N3O5/c24-17(23-9-3-6-16(23)20(27)28)8-7-14-18-12(10-15(21-14)19(25)26)11-4-1-2-5-13(11)22-18/h1-2,4-5,10,16,22H,3,6-9H2,(H,25,26)(H,27,28)/t16-/m0/s1
InChIKeyVSQKKTIEHWELDM-INIZCTEOSA-N
Species of MetaboliteComponentSourceComments
Mycena metata (ncbitaxon:1033252) - PubMed (23330951)
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
Metatacarboline A (CHEBI:215285) is a harmala alkaloid (CHEBI:61379)
IUPAC Name 
1-[3-[(2S)-2-carboxypyrrolidin-1-yl]-3-oxopropyl]-9H-pyrido[3,4-b]indole-3-carboxylic acid
Manual XrefsDatabases
58917832ChemSpider