Compound Identification
SMILES
COC1=CC2=C(C=C1)C(O[C@@H]1CC(N(C1)C(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)(C)C)C(=O)NC1=CC=C(Br)C=C1)=CC(=N2)C1=CC=CC=C1
InChIKey
InChIKey=CKOPDDAKEVOYBB-PHIPGABLSA-N
Formula
C38H43BrN4O6
Mass
731.688
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
-
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
Phenylquinolines Valine and derivatives Proline and derivatives Alpha amino acid amides Phenylpyridines Anilides Anisoles N-acylpyrrolidines N-arylamides Pyrrolidinecarboxamides Bromobenzenes Alkyl aryl ethers Aryl bromides Tertiary carboxylic acid amides Heteroaromatic compounds Carbamate esters Secondary carboxylic acid amides Azacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Organobromides Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-dipeptide - Phenylquinoline - Valine or derivatives - Proline or derivatives - 2-phenylpyridine - Alpha-amino acid amide - Alpha-amino acid or derivatives - Quinoline - Anilide - N-acylpyrrolidine - Phenol ether - Anisole - Pyrrolidine carboxylic acid or derivatives - Pyrrolidine-2-carboxamide - N-arylamide - Bromobenzene - Halobenzene - Alkyl aryl ether - Aryl bromide - Pyridine - Benzenoid - Monocyclic benzene moiety - Aryl halide - Tertiary carboxylic acid amide - Pyrrolidine - Carbamic acid ester - Heteroaromatic compound - Secondary carboxylic acid amide - Carboxamide group - Ether - Organoheterocyclic compound - Azacycle - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organohalogen compound - Organobromide - 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