Compound Identification
SMILES
CCC(C)C(N)C(=O)OCOC(=O)OC1=C(C=CC(F)=C1[C@@H]1C[C@@H]1NC(=O)NC1=NC=C(Br)C=C1)C(=O)CC
InChIKey
InChIKey=WEILHACQFHLLEO-HZGDXXBOSA-N
Formula
C26H30BrFN4O7
Mass
609.449
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
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
-
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
Alkyl-phenylketones Alpha amino acid esters Phenylpropanes Phenoxy compounds Aryl alkyl ketones Benzoyl derivatives Fatty acid esters Fluorobenzenes Pyridines and derivatives Aryl bromides Aryl fluorides Carbonic acid diesters Imidolactams Heteroaromatic compounds Carboxylic acid esters Ureas Monocarboxylic acids and derivatives Azacyclic compounds Acetals Hydrocarbon derivatives Monoalkylamines Organic oxides Organobromides Organofluorides Organopnictogen compounds Aldehydes
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Isoleucine or derivatives - Alpha-amino acid ester - Alkyl-phenylketone - Phenylpropane - Phenylketone - Benzoyl - Aryl ketone - Aryl alkyl ketone - Phenoxy compound - Fluorobenzene - Fatty acid ester - Halobenzene - Aryl fluoride - Aryl bromide - Aryl halide - Carbonic acid diester - Monocyclic benzene moiety - Pyridine - Benzenoid - Fatty acyl - Imidolactam - Heteroaromatic compound - Urea - Carboxylic acid ester - Carbonic acid derivative - Ketone - Acetal - Azacycle - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Organic nitrogen compound - Primary aliphatic amine - Organohalogen compound - Organobromide - Organofluoride - Carbonyl group - Organonitrogen compound - Organooxygen compound - Primary amine - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Amine - Organic oxygen compound - Aldehyde - Aromatic heteromonocyclic 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