Compound Identification
SMILES
COC1=CC(C=CC(=O)N2C=NC3=C2N=CN=C3N)=C(OC)C=C1
InChIKey
InChIKey=CZTARWGZLPMADW-UHFFFAOYSA-N
Formula
C16H15N5O3
Mass
325.328
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
Dimethoxybenzenes 6-aminopurines Styrenes Phenoxy compounds Anisoles N-acylimidazoles Carbonylimidazoles Aminopyrimidines and derivatives Alkyl aryl ethers Imidolactams Heteroaromatic compounds Azacyclic compounds Primary amines Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cinnamic acid or derivatives - 6-aminopurine - P-dimethoxybenzene - Dimethoxybenzene - Imidazopyrimidine - Purine - Anisole - Phenoxy compound - Phenol ether - Styrene - Methoxybenzene - N-acylimidazole - Alkyl aryl ether - Aminopyrimidine - Imidazole-1-carbonyl group - Pyrimidine - Imidolactam - Benzenoid - N-substituted imidazole - Monocyclic benzene moiety - Heteroaromatic compound - Azole - Imidazole - Organoheterocyclic compound - Azacycle - Ether - Primary amine - Amine - Organic oxygen compound - Organic oxide - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Aromatic heteropolycyclic 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