Compound Identification
SMILES
COC(=O)[C@@]1(CC2=CC=C(F)C=C2)[C@@H]2[C@H](CN1C(=O)C1=CC=CC=C1)CC1=C2C=C(N1CC1=C2OCOCC2=CC(F)=C1)C(=O)N1CCCC1
InChIKey
InChIKey=BFHYULQDPAECKI-ZTKNDDPJSA-N
Formula
C39H37F2N3O6
Mass
681.737
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
Alpha amino acid esters Benzo-1,3-dioxanes Amphetamines and derivatives Benzamides Pyrrolidine carboxylic acids Pyrrole carboxamides Benzoyl derivatives 2-heteroaryl carboxamides N-acylpyrrolidines Fatty acid esters Fluorobenzenes Aryl fluorides Substituted pyrroles Methyl esters Heteroaromatic compounds Tertiary carboxylic acid amides Azacyclic compounds Oxacyclic compounds Monocarboxylic acids and derivatives Acetals Carbonyl compounds Hydrocarbon derivatives Organic oxides Organofluorides Organonitrogen compounds Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-acyl-alpha-amino acid - Alpha-amino acid ester - Amphetamine or derivatives - Benzo-1,3-dioxane - Benzodioxane - Benzamide - Benzoic acid or derivatives - Pyrrolidine carboxylic acid or derivatives - Pyrrolidine carboxylic acid - Pyrrole-2-carboxylic acid or derivatives - Benzoyl - 2-heteroaryl carboxamide - N-acylpyrrolidine - Pyrrole-2-carboxamide - Fluorobenzene - Fatty acid ester - Halobenzene - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Fatty acyl - Benzenoid - Substituted pyrrole - Pyrrolidine - Pyrrole - Methyl ester - Tertiary carboxylic acid amide - Heteroaromatic compound - Carboxylic acid ester - Carboxamide group - Acetal - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Azacycle - Oxacycle - Organofluoride - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organopnictogen compound - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Organohalogen compound - Aromatic heteropolycyclic 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