Compound Identification
SMILES
CC(C)(C)[C@H](NC(=O)[C@H](CCCCOC1=CC=C(Cl)C=C1)CC(O)=O)C(=O)NCCC1=CC=CC=N1
InChIKey
InChIKey=ZQKBZOSJAJZXMB-NTKDMRAZSA-N
Formula
C27H36ClN3O5
Mass
518.05
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
Valine and derivatives Alpha amino acid amides Phenoxy compounds Phenol ethers Medium-chain fatty acids Branched fatty acids Chlorobenzenes Alkyl aryl ethers Halogenated fatty acids Heterocyclic fatty acids Pyridines and derivatives Aryl chlorides N-acyl amines Heteroaromatic compounds Secondary carboxylic acid amides Carboxylic acids Azacyclic compounds Monocarboxylic acids and derivatives Carbonyl compounds Hydrocarbon derivatives Organic oxides Organochlorides Organonitrogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Valine or derivatives - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Phenoxy compound - Phenol ether - Medium-chain fatty acid - Alkyl aryl ether - Heterocyclic fatty acid - Halogenated fatty acid - Halobenzene - Chlorobenzene - Branched fatty acid - Aryl chloride - Aryl halide - N-acyl-amine - Benzenoid - Pyridine - Fatty acid - Fatty acyl - Fatty amide - Monocyclic benzene moiety - Heteroaromatic compound - Carboxamide group - Secondary carboxylic acid amide - Azacycle - Organoheterocyclic compound - Carboxylic acid - Ether - Monocarboxylic acid or derivatives - Organooxygen compound - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Organic oxide - Organochloride - Organohalogen compound - Hydrocarbon derivative - Aromatic heteromonocyclic 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