Compound Identification
SMILES
CC1=C(CNC(=O)[C@H]2N(CSC2(C)C)C(=O)[C@@H](O)C[C@@H](CC2=CN=CO2)C(=O)N[C@@H]2C(O)COC3=CC=CC=C23)C(Cl)=CC=C1
InChIKey
InChIKey=YSWBISQGYFLYCN-YSJHJFQISA-N
Formula
C32H37ClN4O7S
Mass
657.18
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
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
-
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
Direct Parent
Alpha amino acids and derivatives
Alternative Parents
1-benzopyrans Toluenes Alkyl aryl ethers Chlorobenzenes Aryl chlorides N-acyl amines Thiazolidines Tertiary carboxylic acid amides Oxazoles Heteroaromatic compounds Secondary carboxylic acid amides Secondary alcohols Dialkylthioethers Oxacyclic compounds Azacyclic compounds Thiohemiaminal derivatives Hydrocarbon derivatives Organonitrogen compounds Carbonyl compounds Organochlorides Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid or derivatives - Benzopyran - Chromane - 1-benzopyran - Alkyl aryl ether - Chlorobenzene - Halobenzene - Toluene - Aryl chloride - Fatty amide - Aryl halide - N-acyl-amine - Monocyclic benzene moiety - Fatty acyl - Benzenoid - Thiazolidine - Tertiary carboxylic acid amide - Oxazole - Azole - Heteroaromatic compound - Secondary carboxylic acid amide - Secondary alcohol - Carboxamide group - Ether - Oxacycle - Thioether - Hemithioaminal - Azacycle - Dialkylthioether - Organoheterocyclic compound - Alcohol - Carbonyl group - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen 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