Met002138: N-Malonylanthranilate
Metabolite Information
Name
N-Malonylanthranilate
IUPAC Name
2-[(2-carboxyacetyl)amino]benzoic acid
Molecular Formula
C10H9NO5
Molecular Weight
223.18
Exact Mass
223.0480724
SMILES
C1=CC=C(C(=C1)C(=O)O)NC(=O)CC(=O)O
InChIKey
ZDSSCYCDBASEJQ-UHFFFAOYSA-N
InChI
InChI=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)
Other Databases Link
Structure
2D Structure
3D Structure
Classification
(data sourced from ClassyFire)
Kingdom:
Organic compounds
Superclass:
Benzenoids
Class:
Benzene and substituted derivatives
Subclass:
Benzoic acids and derivatives
Crops containing this metabolite
maize
okra
peanut
okra
peanut
Metabolite Spectrum Accession Label