Compound Identification
SMILES
CC1(C)S[C@@H](N[C@H]1C(=O)NCCNC(=O)[C@@H]1N[C@H](SC1(C)C)C(NC(=O)CC1=CC=CC=N1)C(=O)NCC1=C(Cl)C=C(Cl)C=C1)C(NC(=O)CC1=CC=CC=C1)C(=O)NCC1=CC=CC=C1
InChIKey
InChIKey=QWDXKFOKPXQBJR-WPBHUVRQSA-N
Formula
C47H55Cl2N9O6S2
Mass
977.03
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
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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
N-acyl-alpha amino acids and derivatives
Alternative Parents
Alpha amino acid amides Beta amino acids and derivatives Phenylacetamides Dichlorobenzenes Pyridines and derivatives Aryl chlorides Thiazolidines Heteroaromatic compounds Secondary carboxylic acid amides Thiohemiaminal derivatives Secondary amines Azacyclic compounds Dialkylthioethers Carbonyl compounds Hydrocarbon derivatives Organic oxides Organochlorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Beta amino acid or derivatives - Phenylacetamide - 1,3-dichlorobenzene - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Pyridine - Heteroaromatic compound - Thiazolidine - Carboxamide group - Secondary carboxylic acid amide - Secondary amine - Azacycle - Organoheterocyclic compound - Dialkylthioether - Thioether - Hemithioaminal - Organooxygen compound - Organohalogen compound - Organochloride - Organic nitrogen compound - Carbonyl group - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Amine - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as n-acyl-alpha amino acids and derivatives. These are compounds containing an alpha amino acid (or a derivative thereof) which bears an acyl group at its terminal nitrogen atom.
External Descriptors
Not available