Compound Identification
SMILES
COC1=CC=C(C=C1)C(N1C=NC(NC(=O)C(COCC2=CC=CC=C2)NC(=O)C(C)(C)N)=C1)C(=O)N1CCCC1
InChIKey
InChIKey=XZQBGORKTHXPSC-UHFFFAOYSA-N
Formula
C30H38N6O5
Mass
562.671
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
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Subclass
Amino acids, peptides, and analogues
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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 Alpha amino acid amides Phenylacetamides Benzylethers Phenoxy compounds Anisoles N-arylamides N-acylpyrrolidines Methoxybenzenes Alkyl aryl ethers N-substituted imidazoles Imidolactams Heteroaromatic compounds Tertiary carboxylic acid amides Secondary carboxylic acid amides Dialkyl ethers Azacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Monoalkylamines
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alpha-dipeptide - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - N-substituted-alpha-amino acid - Alpha-amino acid or derivatives - Phenylacetamide - Benzylether - Phenoxy compound - Anisole - Methoxybenzene - N-acylpyrrolidine - Phenol ether - N-arylamide - Alkyl aryl ether - Monocyclic benzene moiety - Imidolactam - N-substituted imidazole - Benzenoid - Tertiary carboxylic acid amide - Pyrrolidine - Heteroaromatic compound - Azole - Imidazole - Secondary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Organoheterocyclic compound - Ether - Dialkyl ether - Azacycle - Hydrocarbon derivative - Carbonyl group - Organic nitrogen compound - Primary aliphatic amine - Organic oxygen compound - Organic oxide - Amine - Primary amine - Organonitrogen compound - Organooxygen compound - 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