Compound Identification
SMILES
OC1=CC=C(CCNC(=O)C(N2[C@@H](CC3=CC=CC=C3)C(=O)N3CC4=CC=CC=C4C[C@H]3C2=O)C2=CC=C(C=C2)C#N)C=C1
InChIKey
InChIKey=PJCLFWCQFKNJLI-KOPQTXDBSA-N
Formula
C36H32N4O4
Mass
584.676
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organic acids and derivatives
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Class
Carboxylic acids and derivatives
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Subclass
Amino acids, peptides, and analogues
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Level 5
Peptides
- Level 6 Dipeptides
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Level 5
Peptides
-
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
Peptides
Direct Parent
Dipeptides
Alternative Parents
Tetrahydroisoquinolines Alpha amino acids and derivatives N-piperazineacetamides Phenylacetamides 2,5-dioxopiperazines Benzonitriles N-alkylpiperazines 1-hydroxy-2-unsubstituted benzenoids Tertiary carboxylic acid amides Secondary carboxylic acid amides Lactams Azacyclic compounds Nitriles Hydrocarbon derivatives Carbonyl compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-dipeptide - Alpha-amino acid or derivatives - N-piperazineacetamide - Phenylacetamide - Tetrahydroisoquinoline - Benzonitrile - Dioxopiperazine - 2,5-dioxopiperazine - 1-hydroxy-2-unsubstituted benzenoid - Phenol - N-alkylpiperazine - Monocyclic benzene moiety - 1,4-diazinane - Benzenoid - Piperazine - Tertiary carboxylic acid amide - Carboxamide group - Lactam - Secondary carboxylic acid amide - Nitrile - Carbonitrile - Azacycle - Organoheterocyclic compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Carbonyl group - Cyanide - Organooxygen compound - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as dipeptides. These are organic compounds containing a sequence of exactly two alpha-amino acids joined by a peptide bond.
External Descriptors
Not available