Compound Identification
SMILES
CC1(C)CCCN(C1)C(=O)CN1C2=CC=CC=C2OC[C@@H](NC(=O)NC2=CC(Cl)=CC=C2)C1=O
InChIKey
InChIKey=BRBURAKVTIWBEE-LJQANCHMSA-N
Formula
C25H29ClN4O4
Mass
484.98
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
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Class
Carboxylic acids and derivatives
-
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
Benzoxazepines Alpha amino acids and derivatives N-phenylureas N-acylpiperidines Alkyl aryl ethers Chlorobenzenes Aryl chlorides Tertiary carboxylic acid amides Ureas Lactams Azacyclic compounds Oxacyclic compounds Organic oxides Carbonyl compounds Organochlorides Organonitrogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-dipeptide - Benzoxazepine - Alpha-amino acid or derivatives - N-phenylurea - N-acyl-piperidine - Alkyl aryl ether - Halobenzene - Chlorobenzene - Aryl chloride - Aryl halide - Benzenoid - Piperidine - Monocyclic benzene moiety - Tertiary carboxylic acid amide - Carboxamide group - Urea - Lactam - Organoheterocyclic compound - Azacycle - Oxacycle - Ether - Organic nitrogen compound - Organohalogen compound - Organochloride - Carbonyl group - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - 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