Compound Identification
SMILES
CSCC[C@H](NC(=O)C1=C(C=C(C=C1)N(CC1=CN=CN1)S(=O)(=O)C1=CC=CC=C1Br)C1=CC=CC=C1)C(O)=O
InChIKey
InChIKey=ILQKVWJSIRLBLV-VWLOTQADSA-N
Formula
C28H27BrN4O5S2
Mass
643.57
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 Methionine 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
Methionine and derivatives
Alternative Parents
Hippuric acids N-acyl-alpha amino acids Biphenyls and derivatives Sulfanilides Benzenesulfonamides Benzenesulfonyl compounds Benzoyl derivatives Imidazolyl carboxylic acids and derivatives Bromobenzenes Thia fatty acids Organosulfonamides Aryl bromides Aminosulfonyl compounds Heteroaromatic compounds Secondary carboxylic acid amides Dialkylthioethers Carboxylic acids Monocarboxylic acids and derivatives Sulfenyl compounds Azacyclic compounds Carbonyl compounds Organic oxides Organobromides Organonitrogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Methionine or derivatives - N-acyl-alpha-amino acid - N-acyl-alpha amino acid or derivatives - Hippuric acid - Hippuric acid or derivatives - Biphenyl - Benzenesulfonamide - Sulfanilide - Benzenesulfonyl group - Benzamide - Benzoic acid or derivatives - Imidazolyl carboxylic acid derivative - Benzoyl - Halobenzene - Bromobenzene - Thia fatty acid - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Fatty acyl - Benzenoid - Organosulfonic acid amide - Heteroaromatic compound - Azole - Aminosulfonyl compound - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Imidazole - Sulfonyl - Carboxamide group - Secondary carboxylic acid amide - Azacycle - Organoheterocyclic compound - Dialkylthioether - Sulfenyl compound - Thioether - Carboxylic acid - Monocarboxylic acid or derivatives - Organosulfur compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Carbonyl group - Organooxygen compound - Organonitrogen compound - Organobromide - Organohalogen compound - Organic nitrogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as methionine and derivatives. These are compounds containing methionine or a derivative thereof resulting from reaction of methionine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.
External Descriptors
Not available