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CHEBI:109895 - β-carboline

ChEBI IDCHEBI:109895
ChEBI Nameβ-carboline
Stars
ASCII Namebeta-carboline
DefinitionThe parent compound of the β-carbolines, a tricyclic structure comprising an indole ring system ortho- fused to C-3 and C-4 of a pyridine ring.
Last Modified25 February 2016
DownloadsMolfile
FormulaC11H8N2
Net Charge0
Average Mass168.199
Monoisotopic Mass168.06875
SMILESc1ccc2c(c1)nc1cnccc12
InChIInChI=1S/C11H8N2/c1-2-4-10-8(3-1)9-5-6-12-7-11(9)13-10/h1-7,13H
InChIKeyAIFRHYZBTHREPW-UHFFFAOYSA-N
Wikipedia
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) - DOI (10.1038/nbt.2488)
Roles Classification
Biological Roles:
marine metabolite  Any metabolite produced during a metabolic reaction in marine macro- and microorganisms.
fungal metabolite  Any eukaryotic metabolite produced during a metabolic reaction in fungi, the kingdom that includes microorganisms such as the yeasts and moulds.
ChEBI Ontology
Outgoing Relation(s)
β-carboline (CHEBI:109895) has role fungal metabolite (CHEBI:76946)
β-carboline (CHEBI:109895) has role marine metabolite (CHEBI:76507)
β-carboline (CHEBI:109895) is a mancude organic heterotricyclic parent (CHEBI:36416)
β-carboline (CHEBI:109895) is a β-carbolines (CHEBI:60834)
Incoming Relation(s)
annomontine (CHEBI:65409) has functional parent β-carboline (CHEBI:109895)
cordysinin D (CHEBI:69428) has functional parent β-carboline (CHEBI:109895)
harmol (CHEBI:192558) has functional parent β-carboline (CHEBI:109895)
cordysinin C (CHEBI:69427) has parent hydride β-carboline (CHEBI:109895)
cordysinin E (CHEBI:69429) has parent hydride β-carboline (CHEBI:109895)
IUPAC Name 
9H-β-carboline
Synonyms  Source
9H-beta-CarbolineChEMBL
beta-carbolineChEMBL
NorharmaneChemIDplus
NorharmanChemIDplus
9H-Pyrido(3,4-B)indoleChemIDplus
2-AzacarbazoleChemIDplus
Manual XrefsDatabases
C20157KEGG COMPOUND
NRHPDBeChem
CPD-15304MetaCyc
HMDB0012897HMDB
Beta-CarbolineWikipedia
LSM-19021LINCS
Registry NumbersSources
Reaxys:128414Reaxys
CAS:244-63-3ChemIDplus
CAS:244-63-3NIST Chemistry WebBook
Citations