Compound Identification
SMILES
CC1=NN=C(O1)SCC1=C(N2[C@@H](SC1)C(NC(=O)NCC1=CC=C(Cl)C=C1)C2=O)C(O)=O
InChIKey
InChIKey=BWDKLJXEXILWLL-VYIIXAMBSA-N
Formula
C19H18ClN5O5S2
Mass
495.95
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
- Level 5 Amino acids and derivatives
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Subclass
Amino acids, peptides, and analogues
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Class
Carboxylic acids and derivatives
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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
Direct Parent
Alpha amino acids and derivatives
Alternative Parents
Cephems Alkylarylthioethers Chlorobenzenes 1,3-thiazines Aryl chlorides 1,3,4-oxadiazoles Tertiary carboxylic acid amides Heteroaromatic compounds Ureas Azetidines Dialkylthioethers Carboxylic acids Thiohemiaminal derivatives Azacyclic compounds Oxacyclic compounds Sulfenyl compounds Monocarboxylic acids and derivatives Organic oxides Organochlorides Organonitrogen compounds Carbonyl compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid or derivatives - Cephem - Aryl thioether - Halobenzene - Alkylarylthioether - Chlorobenzene - Aryl halide - Monocyclic benzene moiety - Benzenoid - Meta-thiazine - Aryl chloride - Azole - Beta-lactam - 1,3,4-oxadiazole - Oxadiazole - Tertiary carboxylic acid amide - Heteroaromatic compound - Lactam - Urea - Azetidine - Carboxamide group - Thioether - Hemithioaminal - Monocarboxylic acid or derivatives - Sulfenyl compound - Dialkylthioether - Organoheterocyclic compound - Azacycle - Carboxylic acid - Oxacycle - Organic nitrogen compound - Carbonyl group - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as alpha amino acids and derivatives. These are amino acids in which the amino group is attached to the carbon atom immediately adjacent to the carboxylate group (alpha carbon), or a derivative thereof.
External Descriptors
Not available