MetaNetX
Automated Model Construction and Genome Annotation for Large-Scale Metabolic Networks

Feedback

beta-carboline

	Properties	Image
MNX_ID	MNXM43781
reference	chebi:109895
formula	C₁₁H₈N₂
global charge	0
mol weight	168.199
InChIKey	AIFRHYZBTHREPW-UHFFFAOYSA-N
InChI	InChI=1S/C11H8N2/c1-2-4-10-8(3-1)9-5-6-12-7-11(9)13-10/h1-7,13H
SMILES	C1=CC2=C(C=C1)C1=C(C=NC=C1)N2

MNX internals

InChI (mnx)	InChI=1/C11H8N2/c1-2-4-10-8(3-1)9-5-6-12-7-11(9)13-10/h1-7,13H
SMILES (mnx)	[CH:1]1=[CH:2][CH:4]=[C:10]2[C:8](=[CH:3]1)[C:9]1=[CH:5][CH:6]=[N:12][CH:7]=[C:11]1[NH:13]2

Parent-child relations graph

Occurences in reactions	#reac
in my sandbox	0
in MNXref (generic)	3
in models (compartimentalized)	1

Similar chemical compounds in external resources
Identifier	Description
CHEBI:109895 chebi:109895 AIFRHYZBTHREPW-UHFFFAOYSA-N	beta-carboline 2,9-Diazafluorene 2-Azacarbazole 9H-Pyrido(3,4-B)indole 9H-beta-Carboline 9H-beta-carboline 9H-pyrido[3,4-b]indole Carbazoline Norharman Norharmane
bigg.metabolite:CE3087 biggM:CE3087 AIFRHYZBTHREPW-UHFFFAOYSA-N	Beta-carboline
sabiork.compound:25502 sabiorkM:25502 AIFRHYZBTHREPW-UHFFFAOYSA-N	Norharmane
hmdb:HMDB0012897 AIFRHYZBTHREPW-UHFFFAOYSA-N	beta-Carboline 2,9-Diazafluorene 2-Azacarbazole 9H-Pyrido(3,4-b)indole 9H-Pyrido[3,4-b]indole 9H-b-Carboline 9H-beta-Carboline 9H-beta-carboline 9H-pyrido[3,4-b]indole Carbazoline Norharman Norharman hydrochloride Norharmane Norhormane b-Carboline beta-carboline
kegg.compound:C20157 keggC:C20157 AIFRHYZBTHREPW-UHFFFAOYSA-N	beta-Carboline Norharman
seed.compound:cpd21390 seedM:cpd21390 AIFRHYZBTHREPW-UHFFFAOYSA-N	beta-Carboline Norharman beta-carboline carbazoline norharman
vmhM:CE3087 vmhmetabolite:CE3087 AIFRHYZBTHREPW-UHFFFAOYSA-N	beta-carboline 9H-pyrido[3,4-b]indole
metacyc.compound:CPD-15304 metacycM:CPD-15304 AIFRHYZBTHREPW-UHFFFAOYSA-N	norharman beta-carboline carbazoline
hmdb:HMDB12897 biggM:M_CE3087 keggC:M_C20157 seedM:M_cpd21390 vmhM:M_CE3087	secondary/obsolete/fantasy identifier