Compound Identification
SMILES
COC(=O)[C@H](CCSC)NC(=O)NC1=CC=CC(=C1)C1=NC2=CC=CC=C2O1
InChIKey
InChIKey=XWEJXNAAOQVNRQ-INIZCTEOSA-N
Formula
C20H21N3O4S
Mass
399.47
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
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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
Methionine and derivatives
Alternative Parents
Alpha amino acid esters N-carbamoyl-alpha amino acids Phenyl-1,3-oxazoles N-phenylureas Benzoxazoles Fatty acid esters Heteroaromatic compounds Methyl esters Ureas Sulfenyl compounds Azacyclic compounds Oxacyclic compounds Dialkylthioethers Monocarboxylic acids and derivatives Organopnictogen compounds Organonitrogen compounds Hydrocarbon derivatives Organic oxides Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Methionine or derivatives - Alpha-amino acid ester - N-carbamoyl-alpha-amino acid or derivatives - N-carbamoyl-alpha-amino acid - Phenyl-1,3-oxazole - N-phenylurea - Benzoxazole - Fatty acid ester - Fatty acyl - Monocyclic benzene moiety - Benzenoid - Oxazole - Azole - Methyl ester - Heteroaromatic compound - Carboxylic acid ester - Carbonic acid derivative - Urea - Oxacycle - Monocarboxylic acid or derivatives - Azacycle - Organoheterocyclic compound - Dialkylthioether - Sulfenyl compound - Thioether - Organic oxygen compound - Organic nitrogen compound - Organopnictogen compound - Organic oxide - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Aromatic heteropolycyclic 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