Compound Identification
SMILES
COC1=C(OCCCCCC(=O)OCC(Cl)(Cl)Cl)C=C(NC(=O)OCC=C)C(=C1)C(=O)N1CCC[C@H]1C(O)=O
InChIKey
InChIKey=PLRNPBVGOVAQFD-SFHVURJKSA-N
Formula
C25H31Cl3N2O9
Mass
609.88
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
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Class
Carboxylic acids and derivatives
-
Subclass
Amino acids, peptides, and analogues
-
Level 5
Amino acids and derivatives
-
Level 6
Alpha amino acids and derivatives
-
Level 7
N-acyl-alpha amino acids and derivatives
- Level 8 N-acyl-alpha amino acids
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Level 7
N-acyl-alpha amino acids and derivatives
-
Level 6
Alpha amino acids and derivatives
-
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 - N-acyl-alpha amino acids and derivatives
Direct Parent
N-acyl-alpha amino acids
Alternative Parents
Proline and derivatives Phenylcarbamic acid esters Benzamides Methoxyanilines Benzoyl derivatives Methoxybenzenes N-acylpyrrolidines Anisoles Phenoxy compounds Pyrrolidine carboxylic acids Alkyl aryl ethers Fatty acid esters Dicarboxylic acids and derivatives Carbamate esters Tertiary carboxylic acid amides Vinylogous amides Carboxylic acid esters Azacyclic compounds Carboxylic acids Carbonyl compounds Hydrocarbon derivatives Organic oxides Organochlorides Alkyl chlorides Organonitrogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N-acyl-alpha-amino acid - Proline or derivatives - Phenylcarbamic acid ester - Methoxyaniline - Benzoic acid or derivatives - Benzamide - N-acylpyrrolidine - Phenol ether - Pyrrolidine carboxylic acid - Pyrrolidine carboxylic acid or derivatives - Benzoyl - Phenoxy compound - Methoxybenzene - Anisole - Alkyl aryl ether - Fatty acid ester - Benzenoid - Fatty acyl - Dicarboxylic acid or derivatives - Monocyclic benzene moiety - Carbamic acid ester - Tertiary carboxylic acid amide - Vinylogous amide - Pyrrolidine - Carboxamide group - Carboxylic acid ester - Ether - Carboxylic acid - Organoheterocyclic compound - Azacycle - Organonitrogen compound - Organooxygen compound - Alkyl chloride - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Alkyl halide - Organochloride - Organohalogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as n-acyl-alpha amino acids. These are compounds containing an alpha amino acid which bears an acyl group at its terminal nitrogen atom.
External Descriptors
Not available