Compound Identification
SMILES
CCOC(=O)[C@H](CC(C)C)NS(=O)(=O)C1=CC=C(C=C1)N1CCC2(CC1)OCCO2
InChIKey
InChIKey=BCTGLGVBGULISE-IBGZPJMESA-N
Formula
C21H32N2O6S
Mass
440.56
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
-
Subclass
Amino acids, peptides, and analogues
-
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
Alpha amino acid esters Phenylpiperidines Aminobenzenesulfonamides Azaspirodecane derivatives Benzenesulfonyl compounds Aniline and substituted anilines Dialkylarylamines Ketals Fatty acid esters Organosulfonamides 1,3-dioxolanes Aminosulfonyl compounds Carboxylic acid esters Oxacyclic compounds Monocarboxylic acids and derivatives Azacyclic compounds Organopnictogen compounds Hydrocarbon derivatives Organic oxides Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Leucine or derivatives - Alpha-amino acid ester - Phenylpiperidine - Aminobenzenesulfonamide - Benzenesulfonamide - Azaspirodecane - Benzenesulfonyl group - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Aniline or substituted anilines - Fatty acid ester - Ketal - Organosulfonic acid amide - Fatty acyl - Benzenoid - Piperidine - Monocyclic benzene moiety - Organosulfonic acid or derivatives - Meta-dioxolane - Aminosulfonyl compound - Organic sulfonic acid or derivatives - Sulfonyl - Carboxylic acid ester - Tertiary amine - Monocarboxylic acid or derivatives - Azacycle - Oxacycle - Organoheterocyclic compound - Acetal - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Amine - Organic oxygen compound - 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