Compound Identification
SMILES
CC[C@H](C)[C@H](NC(=O)OCC1C2=CC=CC=C2C2=CC=CC=C12)C(=O)N1C[C@H](O)C[C@H]1C#N
InChIKey
InChIKey=JRZJPVBKTCYTAE-KKFFFLSNSA-N
Formula
C26H29N3O4
Mass
447.535
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
Class
Carboxylic acids and derivatives
-
Subclass
Amino acids, peptides, and analogues
-
Level 5
Amino acids and derivatives
-
Level 6
Alpha amino acids and derivatives
- Level 7 Isoleucine 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
Isoleucine and derivatives
Alternative Parents
Fluorenes Alpha amino acid amides N-acylpyrrolidines Tertiary carboxylic acid amides Carbamate esters Secondary alcohols Nitriles Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Isoleucine or derivatives - Fluorene - Alpha-amino acid amide - N-acylpyrrolidine - Benzenoid - Pyrrolidine - Tertiary carboxylic acid amide - Carbamic acid ester - Carboxamide group - Secondary alcohol - Nitrile - Carbonitrile - Azacycle - Organoheterocyclic compound - Hydrocarbon derivative - Organic nitrogen compound - Organic oxide - Organooxygen compound - Organonitrogen compound - Cyanide - Organic oxygen compound - Alcohol - Carbonyl group - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as isoleucine and derivatives. These are compounds containing isoleucine or a derivative thereof resulting from reaction of isoleucine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.
External Descriptors
Not available