Compound Identification
SMILES
CC(=O)N1CCC2=C(C1)C(=NN2CC(O)CN1CCC(CC1)N1C(=O)N(C2CCOC2=O)C2=CC=CC=C12)C1=CC(C)=C(Cl)C=C1
InChIKey
InChIKey=OKEHREMXULHURQ-UHFFFAOYSA-N
Formula
C34H39ClN6O5
Mass
647.17
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
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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
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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
Alpha amino acid esters
Alternative Parents
Phenylpyrazoles Benzimidazoles Chlorobenzenes Toluenes Aryl chlorides Gamma butyrolactones N-substituted imidazoles Piperidines Heteroaromatic compounds Acetamides Oxolanes Tertiary carboxylic acid amides 1,2-aminoalcohols Trialkylamines Carboxylic acid esters Ureas Secondary alcohols Oxacyclic compounds Monocarboxylic acids and derivatives Azacyclic compounds Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid ester - Phenylpyrazole - Benzimidazole - Chlorobenzene - Halobenzene - Toluene - Aryl chloride - Aryl halide - Piperidine - Monocyclic benzene moiety - N-substituted imidazole - Benzenoid - Gamma butyrolactone - Tertiary carboxylic acid amide - Imidazole - Acetamide - Pyrazole - Heteroaromatic compound - Azole - Oxolane - 1,2-aminoalcohol - Carboxamide group - Carboxylic acid ester - Urea - Tertiary aliphatic amine - Tertiary amine - Lactone - Secondary alcohol - Organoheterocyclic compound - Azacycle - Oxacycle - Monocarboxylic acid or derivatives - Amine - Organic nitrogen compound - Alcohol - Carbonyl group - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic 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