Compound Identification
SMILES
CC(C)CC(NC(=O)C1=CC(NC(=S)NC2=C(Br)C=C(C=C2)C(C)C)C(OC(=O)NCCCl)C(C1)OC(=O)NCCCl)C(N)=O
InChIKey
InChIKey=RVVQGKDONBVYNA-UHFFFAOYSA-N
Formula
C29H41BrCl2N6O6S
Mass
752.55
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
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Subclass
Amino acids, peptides, and analogues
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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
N-acyl-alpha amino acids and derivatives N-phenylthioureas Phenylpropanes Cumenes Bromobenzenes Aryl bromides Fatty amides Carbamate esters Thioureas Secondary carboxylic acid amides Primary carboxylic acid amides Hydrocarbon derivatives Organic oxides Carbonyl compounds Organobromides Organochlorides Organonitrogen compounds Alkyl chlorides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Leucine or derivatives - N-acyl-alpha amino acid or derivatives - N-phenylthiourea - Cumene - Phenylpropane - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Fatty acyl - Benzenoid - Fatty amide - Carbamic acid ester - Carboxamide group - Thiourea - Secondary carboxylic acid amide - Primary carboxylic acid amide - Organooxygen compound - Organosulfur compound - Organic nitrogen compound - Alkyl halide - Alkyl chloride - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organohalogen compound - Organobromide - Organochloride - Organonitrogen compound - Aromatic homomonocyclic 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