Structure Information
Structure

Compound Identification

SMILES

CNCC(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC1=CC=C(O)C=C1)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CC1=CN=CN1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC1=CC=CC=C1)C(O)=O

InChIKey

InChIKey=XBTKWSBZQSVHPO-ZTYVOHGWSA-N

Formula

C49H70N14O12

Mass

1047.185

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic acids and derivatives

Class

Carboxylic acids and derivatives

Subclass

Amino acids, peptides, and analogues

Intermediate Tree Nodes

Not available

Direct Parent

Peptides

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Alpha peptide - Tyrosine or derivatives - Phenylalanine or derivatives - Histidine or derivatives - Glutamic acid or derivatives - N-acyl-alpha amino acid or derivatives - Proline or derivatives - N-acyl-alpha-amino acid - N-acyl-l-alpha-amino acid - Alpha-amino acid amide - 3-phenylpropanoic-acid - N-substituted-alpha-amino acid - Alpha-amino acid or derivatives - Amphetamine or derivatives - N-acylpyrrolidine - Pyrrolidine-2-carboxamide - Pyrrolidine carboxylic acid or derivatives - Imidazolyl carboxylic acid derivative - Phenol - 1-hydroxy-2-unsubstituted benzenoid - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Fatty amide - N-acyl-amine - Fatty acyl - Benzenoid - Tertiary carboxylic acid amide - Pyrrolidine - Azole - Heteroaromatic compound - Imidazole - Secondary carboxylic acid amide - Amino acid - Carboxamide group - Amino acid or derivatives - Guanidine - Propargyl-type 1,3-dipolar organic compound - Secondary amine - Organic 1,3-dipolar compound - Carboximidamide - Organoheterocyclic compound - Carboxylic acid - Secondary aliphatic amine - Azacycle - Organonitrogen compound - Carbonyl group - Organic nitrogen compound - Primary amine - Organic oxygen compound - Organic oxide - Organooxygen compound - Amine - Hydrocarbon derivative - Primary aliphatic amine - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as peptides. These are compounds containing an amide derived from two or more amino carboxylic acid molecules (the same or different) by formation of a covalent bond from the carbonyl carbon of one to the nitrogen atom of another.

External Descriptors

Not available

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