Compound Identification
SMILES
CC[C@H](C)[C@H](NC(=O)OCC1=CC=CC=C1)C(=O)N[C@@H](CO)[C@@H](O)[C@@H](O)[C@H](O)C(=O)N[C@@H](CC(O)=O)C1=CC=CC=C1
InChIKey
InChIKey=XEHOYQWPFZDWJR-QEIHRNPNSA-N
Formula
C29H39N3O10
Mass
589.642
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Organic acids and derivatives
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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
Alpha amino acid amides Phenylpropanoic acids Beta amino acids and derivatives Benzyloxycarbonyls N-acyl amines Monosaccharides Carbamate esters Secondary carboxylic acid amides Secondary alcohols 1,2-diols Monocarboxylic acids and derivatives Carboxylic acids Hydrocarbon derivatives Primary alcohols Organic oxides Carbonyl compounds Organonitrogen compounds
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Isoleucine or derivatives - Alpha-amino acid amide - Beta amino acid or derivatives - 3-phenylpropanoic-acid - Benzyloxycarbonyl - Fatty amide - Monocyclic benzene moiety - Fatty acyl - Benzenoid - Monosaccharide - N-acyl-amine - Carbamic acid ester - 1,2-diol - Secondary carboxylic acid amide - Secondary alcohol - Carboxamide group - Carboxylic acid - Monocarboxylic acid or derivatives - Polyol - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Carbonyl group - Primary alcohol - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Alcohol - Aromatic homomonocyclic 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