Compound Identification
SMILES
COC1=CC=C(C=C(NC(=O)C2=CC=CC=C2)C(=O)NCC(=O)OCC(=O)C2=CC=C(Cl)C=C2)C=C1
InChIKey
InChIKey=QTNHSWUBHPGMIG-UHFFFAOYSA-N
Formula
C27H23ClN2O6
Mass
506.94
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
Class
Carboxylic acids and derivatives
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Subclass
Amino acids, peptides, and analogues
- Level 5 Peptides
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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
Not available
Direct Parent
Peptides
Alternative Parents
Alkyl-phenylketones Alpha amino acid esters Hippuric acids and derivatives N-acyl-alpha amino acids and derivatives Alpha amino acid amides Cinnamic acid amides Methoxybenzenes Benzoyl derivatives Aryl alkyl ketones Anisoles Phenoxy compounds Chlorobenzenes Alpha-acyloxy ketones Alkyl aryl ethers Aryl chlorides Secondary carboxylic acid amides Carboxylic acid esters Monocarboxylic acids and derivatives Hydrocarbon derivatives Organonitrogen compounds Organochlorides Organic oxides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Alpha peptide - Hippuric acid or derivatives - Alpha-amino acid ester - Alkyl-phenylketone - N-acyl-alpha amino acid or derivatives - Cinnamic acid or derivatives - Alpha-amino acid amide - Cinnamic acid amide - Alpha-amino acid or derivatives - Phenylketone - Benzoic acid or derivatives - Benzamide - Phenoxy compound - Methoxybenzene - Benzoyl - Aryl alkyl ketone - Anisole - Phenol ether - Aryl ketone - Halobenzene - Alpha-acyloxy ketone - Chlorobenzene - Alkyl aryl ether - Benzenoid - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Carboxylic acid ester - Carboxamide group - Secondary carboxylic acid amide - Ketone - Monocarboxylic acid or derivatives - Ether - Organochloride - Carbonyl group - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organohalogen compound - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as peptides. These are compounds containing an amide derived from two or more amino carboxylic acid molecules (the same or different) by formation of a covalent bond from the carbonyl carbon of one to the nitrogen atom of another.
External Descriptors
Not available