Compound Identification
SMILES
NC1=NN=C2N=C(C(C(=O)C=CC3=CC(O)=CC=C3)C3=NC4=NN=C(N)N4NC3=O)C(=O)NN12
InChIKey
InChIKey=WIWXNBOJAGXQBM-UHFFFAOYSA-N
Formula
C18H14N12O4
Mass
462.39
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Cinnamic acids and derivatives
Subclass
Hydroxycinnamic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Hydroxycinnamic acids and derivatives
Alternative Parents
Styrenes 1-hydroxy-4-unsubstituted benzenoids 1-hydroxy-2-unsubstituted benzenoids 1,2,4-triazines Triazoles Heteroaromatic compounds Enones Acryloyl compounds Lactams Ketones Azacyclic compounds Primary amines Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Hydroxycinnamic acid or derivatives - Styrene - 1-hydroxy-2-unsubstituted benzenoid - 1-hydroxy-4-unsubstituted benzenoid - Phenol - Monocyclic benzene moiety - 1,2,4-triazine - Benzenoid - Triazine - Azole - Heteroaromatic compound - Enone - Alpha,beta-unsaturated ketone - 1,2,4-triazole - Acryloyl-group - Ketone - Lactam - Azacycle - Organoheterocyclic compound - Primary amine - Amine - Organic nitrogen compound - Organic oxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as hydroxycinnamic acids and derivatives. These are compounds containing an cinnamic acid (or a derivative thereof) where the benzene ring is hydroxylated.
External Descriptors
Not available