Compound Identification
SMILES
CCC(C)[C@H](N1C=CC(=O)C[C@H]1C1=CC=C(C=C1)[N+]([O-])=O)C(=O)OC
InChIKey
InChIKey=OANMGNGMBDSKBM-XZNKJRRYSA-N
Formula
C18H22N2O5
Mass
346.383
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
-
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 esters Nitrobenzenes Nitroaromatic compounds Tetrahydropyridines Aralkylamines Fatty acid esters Vinylogous amides Methyl esters Trialkylamines Cyclic ketones Allylamines Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Enamines Monocarboxylic acids and derivatives Organic oxoazanium compounds Organic salts Hydrocarbon derivatives Organic oxides Organic zwitterions
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Isoleucine or derivatives - Alpha-amino acid ester - Nitrobenzene - Nitroaromatic compound - Fatty acid ester - Tetrahydropyridine - Aralkylamine - Monocyclic benzene moiety - Hydropyridine - Fatty acyl - Benzenoid - Methyl ester - Vinylogous amide - Carboxylic acid ester - Ketone - C-nitro compound - Tertiary amine - Tertiary aliphatic amine - Organic nitro compound - Cyclic ketone - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Azacycle - Allyl-type 1,3-dipolar organic compound - Organoheterocyclic compound - Enamine - Organic oxoazanium - Allylamine - Monocarboxylic acid or derivatives - Organic salt - Amine - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organic zwitterion - Organooxygen compound - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - 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