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1,4,5,6-tetrahydro-6-oxonicotinate

Properties

Image

Occurences in reactions

MNX_ID

MNXM2168

	#reac
in my sandbox	0
in MNXref (generic)	7
in models (compartimentalized)	0

formula

C₆H₆NO₃

charge

-1

mass

140.11678

reference

InChIKey

SDKCWSUZEUBWLP-UHFFFAOYSA-M

InChI

InChI=1S/C6H7NO3/c8-5-2-1-4(3-7-5)6(9)10/h3H,1-2H2,(H,7,8)(H,9,10)/p-1

SMILES

[O-]C(=O)C1=CNC(=O)CC1

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:57777 chebi:57777	1,4,5,6-tetrahydro-6-oxonicotinate 1,4,5,6-tetrahydro-6-oxonicotinate anion 6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate
seed.compound:cpd02598 seedM:cpd02598	1,4,5,6-Tetrahydro-6-oxonicotinate 1,4,5,6-Tetrahydro-6-oxonicotinic acid 1,4,5,6-tetrahydro-6-oxonicotinate 6-Oxo-1,4,5,6-tetrahydronicotinate 6-oxo-1,4,5,6-tetrahydronicotinate
sabiork.compound:7167 sabiorkM:7167	1,4,5,6-Tetrahydro-6-oxonicotinate THON
CHEBI:16453 chebi:16453	1,4,5,6-tetrahydro-6-oxonicotinic acid 1,4,5,6-Tetrahydro-6-oxonicotinate 1,4,5,6-Tetrahydro-6-oxonicotinic acid 6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylic acid
kegg.compound:C04226 keggC:C04226	6-Oxo-1,4,5,6-tetrahydronicotinate 1,4,5,6-Tetrahydro-6-oxonicotinate 1,4,5,6-Tetrahydro-6-oxonicotinic acid
metacyc.compound:CPD-283 metacycM:CPD-283	6-oxo-1,4,5,6-tetrahydronicotinate 1,4,5,6-tetrahydro-6-oxonicotinate
chebi:11168 chebi:18925 chebi:533 keggC:M_C04226 seedM:M_cpd02598	secondary/obsolete/fantasy identifier