Compound Identification
SMILES
OC(=O)C(=O)\C=C(\O)C1=CC2=C(C=C1)C(CCC2N=[N+]=[N-])N=[N+]=[N-]
InChIKey
InChIKey=CRQXKCSCNKMHHH-WUXMJOGZSA-N
Formula
C14H12N6O4
Mass
328.288
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Cinnamic acids and derivatives
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Cinnamic acids and derivatives
Alternative Parents
Tetralins Styrenes Alpha-keto acids and derivatives Vinylogous acids Acryloyl compounds Alpha-hydroxy ketones Enones Azo compounds Azo imides Monocarboxylic acids and derivatives Enols Carboxylic acids Organic salts Hydrocarbon derivatives Organic oxides Organic cations
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Cinnamic acid or derivatives - Tetralin - Styrene - Alpha-keto acid - Benzenoid - Keto acid - Acryloyl-group - Alpha-hydroxy ketone - Vinylogous acid - Alpha,beta-unsaturated ketone - Enone - Azo compound - Azo imide - Ketone - Carboxylic acid derivative - Carboxylic acid - Enol - Monocarboxylic acid or derivatives - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Organic salt - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Organic cation - Aromatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as cinnamic acids and derivatives. These are organic aromatic compounds containing a benzene and a carboxylic acid group (or a derivative thereof) forming 3-phenylprop-2-enoic acid.
External Descriptors
Not available