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(N1CCN1C=C(N=C1C)[N+]([O-])=O)C(=O)N(C)C
InChIKey
InChIKey=MGPSVZUYUOZPFU-TUDCREIJSA-N
Formula
C34H35FN6O6
Mass
642.688
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
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 N-acylpyrrolidines Nitroaromatic compounds Nitroimidazoles Benzoyl derivatives Pyrrolidine carboxylic acids 2-heteroaryl carboxamides 1,2,4-trisubstituted imidazoles Pyrrole carboxamides Fatty acid esters Fluorobenzenes Imidolactams Aryl fluorides Substituted pyrroles N-substituted imidazoles Methyl esters Tertiary carboxylic acid amides Heteroaromatic compounds Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Azacyclic compounds Monocarboxylic acids and derivatives Organic oxides Organofluorides Organonitrogen compounds Carbonyl compounds Organic salts Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-acyl-alpha-amino acid - Alpha-amino acid ester - Amphetamine or derivatives - Benzoic acid or derivatives - Benzamide - Nitroimidazole - Trisubstituted imidazole - Benzoyl - Pyrrole-2-carboxylic acid or derivatives - Nitroaromatic compound - Pyrrole-2-carboxamide - N-acylpyrrolidine - Pyrrolidine carboxylic acid - Pyrrolidine carboxylic acid or derivatives - 1,2,4-trisubstituted-imidazole - 2-heteroaryl carboxamide - Fluorobenzene - Halobenzene - Fatty acid ester - Benzenoid - Monocyclic benzene moiety - Substituted pyrrole - Imidolactam - N-substituted imidazole - Fatty acyl - Aryl halide - Aryl fluoride - Heteroaromatic compound - Azole - Imidazole - Methyl ester - Pyrrole - Pyrrolidine - Tertiary carboxylic acid amide - Carboxamide group - Organic nitro compound - Carboxylic acid ester - C-nitro compound - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Monocarboxylic acid or derivatives - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic salt - Organooxygen compound - Organonitrogen compound - Organofluoride - Organic nitrogen compound - Organohalogen compound - Organic oxygen compound - Organic cation - 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