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CHEBI:206617 - Pityriacitrin

ChEBI IDCHEBI:206617
ChEBI NamePityriacitrin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H13N3O
Net Charge0
Average Mass311.344
Monoisotopic Mass311.10586
SMILESO=C(c1cnc2ccccc12)c1nccc2c1nc1ccccc12
InChIInChI=1S/C20H13N3O/c24-20(15-11-22-16-7-3-1-6-13(15)16)19-18-14(9-10-21-19)12-5-2-4-8-17(12)23-18/h1-11,22-23H
InChIKeyBQTUGQOWZZUYIA-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Malassezia furfur (ncbitaxon:55194) - PubMed (12029500)
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)
Pityriacitrin (CHEBI:206617) is a harmala alkaloid (CHEBI:61379)
IUPAC Name 
1H-indol-3-yl(9H-pyrido[3,4-b]indol-1-yl)methanone
Manual XrefsDatabases
28486003ChemSpider