Compound Identification
SMILES
CCOC(=O)[C@H](CCCCNC1=CC(Cl)=C(C=C1C(=O)OCC)S(N)(=O)=O)N(CC1=CC=CC=C1)C(=O)[C@H](C)N([C@@H](CCC1=CC=CC=C1)C(=O)OCC)C(=O)OCC(Cl)(Cl)Cl
InChIKey
InChIKey=UEAPJOLBXIYXAP-UZZXRHIMSA-N
Formula
C42H52Cl4N4O11S
Mass
962.76
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
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Level 5
Amino acids and derivatives
-
Level 6
Alpha amino acids and derivatives
- Level 7 Alpha amino acid esters
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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
Alpha amino acid esters
Alternative Parents
Alanine and derivatives Aminobenzenesulfonamides Benzoic acid esters 4-halobenzoic acids and derivatives Aminobenzoic acids and derivatives Benzenesulfonyl compounds Benzoyl derivatives Phenylalkylamines Aniline and substituted anilines Secondary alkylarylamines Chlorobenzenes Fatty acid esters Organosulfonamides Aryl chlorides Dicarboxylic acids and derivatives Aminosulfonyl compounds Carbamate esters Vinylogous amides Tertiary carboxylic acid amides Carboxylic acid esters Organopnictogen compounds Hydrocarbon derivatives Organic oxides Alkyl chlorides Organochlorides Carbonyl compounds
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Alpha-amino acid ester - Aminobenzenesulfonamide - Alanine or derivatives - Aminobenzoic acid or derivatives - Benzoate ester - 4-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzenesulfonamide - Benzenesulfonyl group - Benzoic acid or derivatives - Benzoyl - Phenylalkylamine - Aniline or substituted anilines - Fatty acid ester - Secondary aliphatic/aromatic amine - Halobenzene - Chlorobenzene - Aryl halide - Aryl chloride - Organosulfonic acid amide - Dicarboxylic acid or derivatives - Fatty acyl - Benzenoid - Monocyclic benzene moiety - Vinylogous amide - Aminosulfonyl compound - Carbamic acid ester - Tertiary carboxylic acid amide - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Carboxylic acid ester - Carboxamide group - Secondary amine - Organooxygen compound - Carbonyl group - Organic oxygen compound - Amine - Organic nitrogen compound - Alkyl halide - Alkyl chloride - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organosulfur compound - Organohalogen compound - Organochloride - Organonitrogen compound - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as alpha amino acid esters. These are ester derivatives of alpha amino acids.
External Descriptors
Not available