Compound Identification
SMILES
CC(N)C1=CC=CC=C1.CCCC1=NN(C)C2=C1N=C(CC)N(CCOC1=CC=C(CC(OCC)C(O)=O)C=C1)C2=O
InChIKey
InChIKey=QQCWWWVNXATJKB-UHFFFAOYSA-N
Formula
C32H43N5O5
Mass
577.726
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
- Class Phenylpropanoic acids
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Phenylpropanoic acids
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpropanoic acids
Alternative Parents
Pyrazolopyrimidines Phenoxy compounds Phenol ethers Pyrimidones Alkyl aryl ethers Aralkylamines Pyrazoles Heteroaromatic compounds Lactams Dialkyl ethers Carboxylic acids Azacyclic compounds Monocarboxylic acids and derivatives Hydrocarbon derivatives Monoalkylamines Carbonyl compounds Organic oxides
Molecular Framework
Not available
Substituents
3-phenylpropanoic-acid - Pyrazolopyrimidine - Phenol ether - Phenoxy compound - Alkyl aryl ether - Pyrimidone - Aralkylamine - Benzenoid - Monocyclic benzene moiety - Pyrimidine - Heteroaromatic compound - Azole - Pyrazole - Lactam - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Carboxylic acid - Dialkyl ether - Ether - Monocarboxylic acid or derivatives - Organic oxide - Carbonyl group - Amine - Primary aliphatic amine - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Organic oxygen compound - Primary amine - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phenylpropanoic acids. These are compounds with a structure containing a benzene ring conjugated to a propanoic acid.
External Descriptors
Not available