Compound Identification
SMILES
CC(C)[C@H](NC(=O)[C@H](NCC1=CC=CC=C1)[C@H](O)[C@H](CC1=CC=CC=C1)NC(=O)[C@@H](NC(=O)N(C)CC1=NC2=CC=CC=C2N1)C(C)C)C(=O)NCC1=CC=CC=C1
InChIKey
InChIKey=BZKSWCPXTIIOKX-KMHPXQNHSA-N
Formula
C45H56N8O5
Mass
788.994
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
Valine and derivatives N-acyl-alpha amino acids and derivatives N-carbamoyl-alpha amino acids and derivatives Alpha amino acid amides Phenylbutylamines Amphetamines and derivatives Benzimidazoles Benzylamines Phenylmethylamines Aralkylamines N-acyl amines Imidazoles Heteroaromatic compounds Secondary carboxylic acid amides Ureas Secondary alcohols Dialkylamines Azacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organopnictogen compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-dipeptide - Valine or derivatives - N-acyl-alpha amino acid or derivatives - N-carbamoyl-alpha-amino acid or derivatives - Alpha-amino acid amide - Phenylbutylamine - N-substituted-alpha-amino acid - Alpha-amino acid or derivatives - Amphetamine or derivatives - Benzimidazole - Benzylamine - Phenylmethylamine - Aralkylamine - Monocyclic benzene moiety - Fatty amide - N-acyl-amine - Benzenoid - Fatty acyl - Heteroaromatic compound - Imidazole - Azole - Urea - Secondary carboxylic acid amide - Carboxamide group - Secondary alcohol - Carbonic acid derivative - Amino acid or derivatives - Organoheterocyclic compound - Azacycle - Secondary amine - Secondary aliphatic amine - Alcohol - Hydrocarbon derivative - Carbonyl group - Organonitrogen compound - Organic oxide - Organooxygen compound - Amine - Organopnictogen compound - Organic oxygen compound - Organic nitrogen 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