Compound Identification
SMILES
C[C@@H](O)[C@@H]1[C@H]2CC(=C(N2C1=O)C(O)=O)C1=CC=C(C[N+]2=CC=C(C=C2)N2CCCC2)C=C1
InChIKey
InChIKey=LTSWNVLAHSLKNZ-NPFVIJTESA-O
Formula
C25H28N3O4
Mass
434.515
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Cinnamic acids and derivatives
- Subclass Cinnamic acids
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Class
Cinnamic acids and derivatives
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Cinnamic acids and derivatives
Subclass
Cinnamic acids
Intermediate Tree Nodes
Not available
Direct Parent
Cinnamic acids
Alternative Parents
Phenylpyrrolines Carbapenems Alpha amino acids and derivatives Pyrroline carboxylic acids Dialkylarylamines Aminopyridines and derivatives Azepines Benzene and substituted derivatives Pyridinium derivatives Tertiary carboxylic acid amides Pyrrolidines Pyrroles Heteroaromatic compounds Secondary alcohols Azetidines Amino acids Carboxylic acids Azacyclic compounds Monocarboxylic acids and derivatives Carbonyl compounds Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cinnamic acid - Carbapenem - 3-phenylpyrroline - Alpha-amino acid or derivatives - Pyrroline carboxylic acid - Dialkylarylamine - Pyrroline carboxylic acid or derivatives - Tertiary aliphatic/aromatic amine - Aminopyridine - Azepine - Monocyclic benzene moiety - Pyridine - Pyridinium - Benzenoid - Pyrroline - Tertiary carboxylic acid amide - Pyrrolidine - Pyrrole - Heteroaromatic compound - Beta-lactam - Secondary alcohol - Tertiary amine - Amino acid or derivatives - Azetidine - Amino acid - Carboxamide group - Lactam - Organoheterocyclic compound - Azacycle - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Carboxylic acid - Organonitrogen compound - Organooxygen compound - Alcohol - Organic nitrogen compound - Organic oxide - Carbonyl group - Amine - Organic oxygen compound - Hydrocarbon derivative - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as cinnamic acids. These are organic aromatic compounds containing a benzene and a carboxylic acid group forming 3-phenylprop-2-enoic acid.
External Descriptors
Not available