Compound Identification
SMILES
NC(N)=NCCC[C@@H](NC(=O)[C@@H](CC1=CC=CC=C1)NC(=O)[C@@H]1CCCN1)C(=O)CCl
InChIKey
InChIKey=HCCRRLVJBLDSLL-IXDOHACOSA-N
Formula
C21H31ClN6O3
Mass
450.97
Taxonomic Classification
Taxonomy Tree
-
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
Phenylalanine and derivatives Proline and derivatives N-acyl-alpha amino acids and derivatives Alpha amino acid amides Amphetamines and derivatives Pyrrolidinecarboxamides Fatty amides Alpha-chloroketones Secondary carboxylic acid amides Guanidines Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Dialkylamines Carboximidamides Hydrocarbon derivatives Organic oxides Organochlorides Organopnictogen compounds Alkyl chlorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alpha-dipeptide - Phenylalanine or derivatives - N-acyl-alpha amino acid or derivatives - Proline or derivatives - Alpha-amino acid amide - N-substituted-alpha-amino acid - Alpha-amino acid or derivatives - Amphetamine or derivatives - Pyrrolidine carboxylic acid or derivatives - Pyrrolidine-2-carboxamide - Monocyclic benzene moiety - Fatty amide - Benzenoid - Fatty acyl - Alpha-haloketone - Pyrrolidine - Alpha-chloroketone - Secondary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Ketone - Guanidine - Propargyl-type 1,3-dipolar organic compound - Carboximidamide - Secondary amine - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Secondary aliphatic amine - Hydrocarbon derivative - Alkyl halide - Organopnictogen compound - Organohalogen compound - Carbonyl group - Alkyl chloride - Organic oxygen compound - Organochloride - Amine - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organic oxide - Aromatic heteromonocyclic 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