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

Feedback

3-hydroxy-1H-quinolin-4-one

	Properties	Image
MNX_ID	MNXM2153
reference	chebi:16569
formula	C₉H₇NO₂
global charge	0
mol weight	161.16
InChIKey	BHTNYVRPYQQOMJ-UHFFFAOYSA-N
InChI	InChI=1S/C9H7NO2/c11-8-5-10-7-4-2-1-3-6(7)9(8)12/h1-5,11H,(H,10,12)
SMILES	O=C1C(O)=CNC2=C1C=CC=C2

MNX internals

InChI (mnx)	InChI=1/C9H7NO2/c11-8-5-10-7-4-2-1-3-6(7)9(8)12/h1-5,11H,(H,10,12)
SMILES (mnx)	[CH:1]1=[CH:2][CH:4]=[C:7]2[C:6](=[CH:3]1)[C:9](=[O:12])[C:8]([OH:11])=[CH:5][NH:10]2

Parent-child relations graph

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

Similar chemical compounds in external resources
Identifier	Description
CHEBI:16569 chebi:16569 BHTNYVRPYQQOMJ-UHFFFAOYSA-N	3-hydroxy-1H-quinolin-4-one 3-Hydroxy-1H-quinolin-4-one 3-hydroxyquinolin-4(1H)-one
seed.compound:cpd08342 seedM:cpd08342 sabiork.compound:13568 sabiorkM:13568 kegg.compound:C11503 keggC:C11503 BHTNYVRPYQQOMJ-UHFFFAOYSA-N	3-Hydroxy-1H-quinolin-4-one
metacyc.compound:3-HYDROXY-1H-QUINOLIN-4-ONE metacycM:3-HYDROXY-1H-QUINOLIN-4-ONE BHTNYVRPYQQOMJ-UHFFFAOYSA-M	3-hydroxy-1H-quinolin-4-one
kegg.compound:C06330 keggC:C06330 BHTNYVRPYQQOMJ-UHFFFAOYSA-N	Quinoline-3,4-diol 3,4-Dihydroxyquinoline
seed.compound:cpd03771 seedM:cpd03771 BHTNYVRPYQQOMJ-UHFFFAOYSA-O	Quinoline-3,4-diol 3,4-Dihydroxyquinoline 3-Hydroxy-1H-quinolin-4-one 3-hydroxy-1H-quinolin-4-one quinolin-3,4-diol
metacyc.compound:QUINOLIN-34-DIOL metacycM:QUINOLIN-34-DIOL BHTNYVRPYQQOMJ-UHFFFAOYSA-N	quinolin-3,4-diol
CHEBI:57819 chebi:57819 BHTNYVRPYQQOMJ-UHFFFAOYSA-M	quinolin-4(1H)-one-3-olate 4-oxo-1,4-dihydroquinolin-3-olate quinolin-4(1H)-one-3-olate anion quinolin-4(1H)-one-3-olate(1-)
CHEBI:28788 chebi:28788 BHTNYVRPYQQOMJ-UHFFFAOYSA-N	quinoline-3,4-diol 3,4-Dihydroxyquinoline 3,4-dihydroxyquinoline Quinoline-3,4-diol
chebi:11801 chebi:15005 chebi:1514 chebi:26503 chebi:8728 keggC:M_C06330 keggC:M_C11503 seedM:M_cpd03771 seedM:M_cpd08342	secondary/obsolete/fantasy identifier