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(2-aminobenzoyl)acetate

PropertiesImage
MNX_IDMNXM162517 Image of MNXM162517
referencechebi:131446
formulaC9H8NO3
global charge-1
mol weight178.167
InChIKeyPOAXUNDIOGWQOC-UHFFFAOYSA-M
InChIInChI=1S/C9H9NO3/c10-7-4-2-1-3-6(7)8(11)5-9(12)13/h1-4H,5,10H2,(H,12,13)/p-1
SMILESNC1=C(C(=O)CC(=O)[O-])C=CC=C1
MNX internals
InChI (mnx)InChI=1/C9H9NO3/c10-7-4-2-1-3-6(7)8(11)5-9(12)13/h1-4H,5,10H2,(H,12,13) Image of MNXM162517
SMILES (mnx)[CH:1]1=[CH:2][CH:4]=[C:7]([NH2:10])[C:6]([C:8]([CH2:5][C:9](=[O:12])[OH:13])=[O:11])=[CH:3]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)9
in models (compartimentalized) 2
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:131446
chebi:131446
POAXUNDIOGWQOC-UHFFFAOYSA-M 		(2-aminobenzoyl)acetate
2-aminobenzoylacetate
3-(2-aminophenyl)-3-oxopropanoate

kegg.compound:C21453
keggC:C21453
POAXUNDIOGWQOC-UHFFFAOYSA-N 		(2-Aminobenzoyl)acetate
2-Aminobenzoylacetate

metacyc.compound:CPD-19114
metacycM:CPD-19114
seed.compound:cpd33421
seedM:cpd33421
POAXUNDIOGWQOC-UHFFFAOYSA-M 		(2-aminobenzoyl)acetate

CHEBI:131950
chebi:131950
POAXUNDIOGWQOC-UHFFFAOYSA-N 		2-aminobenzoylacetic acid
3-(2-aminophenyl)-3-oxopropanoic acid

envipath:...02a0b2047fd5
envipathM:...02a0b2047fd5
POAXUNDIOGWQOC-UHFFFAOYSA-M 		compound 0047135

keggC:M_C21453
seedM:M_cpd33421 		secondary/obsolete/fantasy identifier