Compound Identification
SMILES
COC(=O)CN1C2=C(C=C1C(=O)N1CCCC1)[C@H]1[C@H](CN(C(=O)C3=CC=CC=C3)[C@@]1(CC1=CC=C(F)C=C1)C(=O)OC)C2
InChIKey
InChIKey=BFFRNZIJUCEFRA-CUDUBCGHSA-N
Formula
C33H34FN3O6
Mass
587.648
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 Amphetamines and derivatives Benzamides 2-heteroaryl carboxamides Pyrrolidine carboxylic acids Pyrrole carboxamides N-acylpyrrolidines Benzoyl derivatives Fluorobenzenes Fatty acid esters Substituted pyrroles Aryl fluorides Dicarboxylic acids and derivatives Tertiary carboxylic acid amides Methyl esters Heteroaromatic compounds Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds Organofluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid ester - N-acyl-alpha-amino acid - Amphetamine or derivatives - Benzamide - Benzoic acid or derivatives - 2-heteroaryl carboxamide - N-acylpyrrolidine - Benzoyl - Pyrrole-2-carboxamide - Pyrrole-2-carboxylic acid or derivatives - Pyrrolidine carboxylic acid - Pyrrolidine carboxylic acid or derivatives - Fluorobenzene - Halobenzene - Fatty acid ester - Aryl fluoride - Aryl halide - Fatty acyl - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Substituted pyrrole - Benzenoid - Methyl ester - Tertiary carboxylic acid amide - Heteroaromatic compound - Pyrrole - Pyrrolidine - Carboxamide group - Carboxylic acid ester - Organoheterocyclic compound - Azacycle - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organofluoride - 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