Compound Identification
SMILES
CCC[C@H](NC(=O)[C@@H]1C[C@@H](OC2=CC(=NC3=C2C=CC(OC)=C3)C2=CC=CC=C2)C=C1C(=O)N[C@H](C(=O)N[C@@H](C1CCCCC1)C(=O)OC)C(C)(C)C)C(=O)OC(C)(C)C
InChIKey
InChIKey=CGXIZEKAPBQRJK-XMPYJLHASA-N
Formula
C47H62N4O9
Mass
827.032
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
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Class
Carboxylic acids and derivatives
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Subclass
Amino acids, peptides, and analogues
- Level 5 Peptides
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Subclass
Amino acids, peptides, and analogues
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Class
Carboxylic acids and derivatives
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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
Not available
Direct Parent
Peptides
Alternative Parents
Phenylquinolines Valine and derivatives N-acyl-alpha amino acids and derivatives Alpha amino acid esters Phenylpyridines Alpha amino acid amides Anisoles Alkyl aryl ethers Fatty acid esters N-acyl amines Dicarboxylic acids and derivatives Benzene and substituted derivatives Methyl esters Heteroaromatic compounds Secondary carboxylic acid amides Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha peptide - Phenylquinoline - N-acyl-alpha amino acid or derivatives - Alpha-amino acid ester - Valine or derivatives - Alpha-amino acid amide - 2-phenylpyridine - N-substituted-alpha-amino acid - Alpha-amino acid or derivatives - Quinoline - Phenol ether - Anisole - Alkyl aryl ether - Fatty acid ester - Monocyclic benzene moiety - Pyridine - N-acyl-amine - Fatty amide - Dicarboxylic acid or derivatives - Benzenoid - Fatty acyl - Methyl ester - Heteroaromatic compound - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid ester - Organoheterocyclic compound - Azacycle - Ether - Organic oxide - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Aromatic heteropolycyclic 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