Compound Identification
SMILES
COC1=CC2=C(NC(C)=C2CC(=O)N[C@@H](CCCCCC(C)=O)C(=O)NC2=CC(Cl)=CC=C2)C=C1
InChIKey
InChIKey=SOSXIBFYXLNQOM-VWLOTQADSA-N
Formula
C27H32ClN3O4
Mass
498.02
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
Class
Carboxylic acids and derivatives
-
Subclass
Amino acids, peptides, and analogues
- Level 5 Amino acids and derivatives
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Subclass
Amino acids, peptides, and analogues
-
Class
Carboxylic acids and derivatives
-
Superclass
Organic acids and derivatives
Kingdom
Organic compounds
Superclass
Organic acids and derivatives
Class
Carboxylic acids and derivatives
Subclass
Amino acids, peptides, and analogues
Intermediate Tree Nodes
Amino acids and derivatives - Alpha amino acids and derivatives
Direct Parent
N-acyl-alpha amino acids and derivatives
Alternative Parents
Alpha amino acid amides 3-alkylindoles Anilides Anisoles N-arylamides Chlorobenzenes Alkyl aryl ethers Fatty amides Aryl chlorides Substituted pyrroles Heteroaromatic compounds Ketones Secondary carboxylic acid amides Azacyclic compounds Hydrocarbon derivatives Organochlorides Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - 3-alkylindole - Indole - Anilide - Indole or derivatives - Anisole - Phenol ether - N-arylamide - Alkyl aryl ether - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Fatty amide - Fatty acyl - Benzenoid - Substituted pyrrole - Pyrrole - Heteroaromatic compound - Secondary carboxylic acid amide - Ketone - Carboxamide group - Organoheterocyclic compound - Azacycle - Ether - Organic oxide - Hydrocarbon derivative - Carbonyl group - Organochloride - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Organic nitrogen compound - Organohalogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as n-acyl-alpha amino acids and derivatives. These are compounds containing an alpha amino acid (or a derivative thereof) which bears an acyl group at its terminal nitrogen atom.
External Descriptors
Not available