Compound Identification
SMILES
CC(NCC1=CC=C(Cl)C=C1)C(=O)N[C@H](CC1=CNC2=CC=CC=C12)C(=O)NCCC1=CC=CC=C1
InChIKey
InChIKey=IIKQMMXJROTBPV-MQBBKVSDSA-N
Formula
C29H31ClN4O2
Mass
503.04
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
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
N-acyl-alpha amino acids and derivatives Tryptamines and derivatives Alpha amino acid amides Alanine and derivatives 3-alkylindoles Phenylmethylamines Benzylamines Aralkylamines Chlorobenzenes Substituted pyrroles Fatty amides Aryl chlorides Heteroaromatic compounds Secondary carboxylic acid amides Dialkylamines Azacyclic compounds Organochlorides Hydrocarbon derivatives Carbonyl compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-dipeptide - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Triptan - Alanine or derivatives - N-substituted-alpha-amino acid - Alpha-amino acid or derivatives - 3-alkylindole - Indole - Indole or derivatives - Benzylamine - Phenylmethylamine - Chlorobenzene - Halobenzene - Aralkylamine - Fatty amide - Fatty acyl - Benzenoid - Monocyclic benzene moiety - Aryl halide - Aryl chloride - Substituted pyrrole - Heteroaromatic compound - Pyrrole - Carboxamide group - Amino acid or derivatives - Secondary carboxylic acid amide - Secondary aliphatic amine - Organoheterocyclic compound - Azacycle - Secondary amine - Organic nitrogen compound - Carbonyl group - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Amine - Organic oxide - 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