Compound Identification
SMILES
[O-]C(=O)CC1=C([NH2+]C=N1)[O-]C(=O)CC1=C(OC(=O)CC2=CN=CN2)[NH+]=CN1
InChIKey
InChIKey=WVEZUMJWJLZYRJ-UHFFFAOYSA-O
Formula
C15H15N6O6
Mass
375.321
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Azoles
- Subclass Imidazoles
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Class
Azoles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Azoles
Subclass
Imidazoles
Intermediate Tree Nodes
Substituted imidazoles
Direct Parent
Substituted imidazole-4-acetic acid and analogues
Alternative Parents
Tricarboxylic acids and derivatives Fatty acid esters Heteroaromatic compounds Carboxylic acid salts Carboxylic acid esters Propargyl-type 1,3-dipolar organic compounds Formamidines Carboxylic acids Carboximidamides Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organic zwitterions Organic salts Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Substituted imidazole-4-acetic acid or analogues - Tricarboxylic acid or derivatives - Fatty acid ester - Fatty acyl - Heteroaromatic compound - Carboxylic acid salt - Carboxylic acid ester - Formamidine - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboximidamide - Carboxylic acid - Carboxylic acid derivative - Amidine - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organic salt - Organic zwitterion - Organooxygen compound - Organonitrogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as substituted imidazole-4-acetic acid and analogues. These are aromatic heterocyclic compounds containing an imidazole ring, which is substituted at the 4-position by acetic acid (or a derivative thereof), and at the 2- or 5-position by any group.
External Descriptors
Not available