Compound Identification
SMILES
CC1(C)SCN([C@@H]1C(=O)NCC1=C(Cl)C=CC=C1Cl)C(=O)[C@@H](O)C[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H]1[C@H](O)COC2=CC=CC=C12
InChIKey
InChIKey=KNZXQUNBQJDYHJ-JXCVSLFXSA-N
Formula
C34H37Cl2N3O6S
Mass
686.65
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 Dichlorobenzenes Alkyl aryl ethers Aryl chlorides N-acyl amines Thiazolidines Tertiary carboxylic acid amides Secondary carboxylic acid amides Secondary alcohols Thiohemiaminal derivatives Oxacyclic compounds Azacyclic compounds Dialkylthioethers Hydrocarbon derivatives Carbonyl compounds Organic oxides Organochlorides Organonitrogen compounds Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Chromane - Alpha-amino acid or derivatives - Benzopyran - 1-benzopyran - 1,3-dichlorobenzene - Alkyl aryl ether - Chlorobenzene - Halobenzene - N-acyl-amine - Benzenoid - Aryl halide - Aryl chloride - Fatty acyl - Fatty amide - Monocyclic benzene moiety - Thiazolidine - Tertiary carboxylic acid amide - Carboxamide group - Secondary carboxylic acid amide - Secondary alcohol - Oxacycle - Hemithioaminal - Dialkylthioether - Organoheterocyclic compound - Thioether - Ether - Azacycle - Alcohol - Organohalogen compound - Organochloride - Carbonyl group - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - 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