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N-malonylanthranilate

PropertiesImage
MNX_IDMNXM4735 Image of MNXM4735
referencechebi:16872
formulaC10H7NO5
global charge-2
mol weight221.168
InChIKeyZDSSCYCDBASEJQ-UHFFFAOYSA-L
InChIInChI=1S/C10H9NO5/c12-8(5-9(13)14)11-7-4-2-1-3-6(7)10(15)16/h1-4H,5H2,(H,11,12)(H,13,14)(H,15,16)/p-2
SMILESO=C([O-])CC(=O)NC1=CC=CC=C1C(=O)[O-]
MNX internals
InChI (mnx)InChI=1/C10H9NO5/c12-8(5-9(13)14)11-7-4-2-1-3-6(7)10(15)16/h1-4H,5H2,(H,11,12)(H,13,14)(H,15,16) Image of MNXM4735
SMILES (mnx)[CH:1]1=[CH:2][CH:4]=[C:7]([N:11]=[C:8]([CH2:5][C:9](=[O:13])[OH:14])[OH:12])[C:6]([C:10](=[O:15])[OH:16])=[CH:3]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)1
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:16872
chebi:16872
ZDSSCYCDBASEJQ-UHFFFAOYSA-L 		N-malonylanthranilate
2-[(carboxylatoacetyl)amino]benzoate
N-Malonylanthranilate
hmdb:HMDB0039495
ZDSSCYCDBASEJQ-UHFFFAOYSA-N 		2-(Malonylamino)benzoic acid
2-(2-carboxyacetamido)benzoic acid
2-(Malonylamino)benzoate
2-[(2-Carboxyacetyl)amino]benzenecarboxylic acid
2-[(Carboxyacetyl)amino]benzoic acid, 9ci
N-Malonylanthranilate
N-Malonylanthranilic acid
N-malonylanthranilic acid

kegg.compound:C03147
keggC:C03147
vmhM:nmantnlt
vmhmetabolite:nmantnlt
ZDSSCYCDBASEJQ-UHFFFAOYSA-L
ZDSSCYCDBASEJQ-UHFFFAOYSA-N 		N-Malonylanthranilate

seed.compound:cpd02014
seedM:cpd02014
ZDSSCYCDBASEJQ-UHFFFAOYSA-L 		N-Malonylanthranilate
N-malonylanthranilate

metacyc.compound:CPD-422
metacycM:CPD-422
ZDSSCYCDBASEJQ-UHFFFAOYSA-L 		N-malonylanthranilate

CHEBI:52430
chebi:52430
ZDSSCYCDBASEJQ-UHFFFAOYSA-N 		N-malonylanthranilic acid
2-[(carboxyacetyl)amino]benzoic acid

hmdb:HMDB39495
chebi:12514
chebi:21747
chebi:7302
keggC:M_C03147
seedM:M_cpd02014
vmhM:M_nmantnlt 		secondary/obsolete/fantasy identifier