Compound Identification
SMILES
CC(C)CC(NC(=O)C1COC2=CC=CC=C2O1)C(=O)NC1CCC[NH+](CC1=O)C(=O)CC1=CC=CC=C1
InChIKey
InChIKey=PQKWPLIVKFCNKC-UHFFFAOYSA-O
Formula
C29H36N3O6
Mass
522.621
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
Amino acids and derivatives
-
Level 6
Alpha amino acids and derivatives
- Level 7 Leucine and derivatives
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Level 6
Alpha amino acids and derivatives
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Level 5
Amino acids and derivatives
-
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
Amino acids and derivatives - Alpha amino acids and derivatives
Direct Parent
Leucine and derivatives
Alternative Parents
N-acyl-alpha amino acids and derivatives Alpha amino acid amides Benzo-1,4-dioxanes Phenylacetamides Alkyl aryl ethers Azepanes N-acyl amines Para dioxins Quaternary ammonium salts Cyclic ketones Secondary carboxylic acid amides Oxacyclic compounds Azacyclic compounds Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Leucine or derivatives - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Benzo-1,4-dioxane - Benzodioxane - Phenylacetamide - Alkyl aryl ether - Azepane - Monocyclic benzene moiety - Fatty amide - N-acyl-amine - Para-dioxin - Fatty acyl - Benzenoid - Quaternary ammonium salt - Cyclic ketone - Secondary carboxylic acid amide - Carboxamide group - Ketone - Organoheterocyclic compound - Oxacycle - Ether - Azacycle - Organonitrogen compound - Carbonyl group - Hydrocarbon derivative - Organooxygen compound - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as leucine and derivatives. These are compounds containing leucine or a derivative thereof resulting from reaction of leucine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.
External Descriptors
Not available