Compound Identification
SMILES
COC1=CC=C(NCCNC(=O)[C@H](CC2CCCCC2)NC(=O)C2=CC3=C(N2)C=CC(F)=C3)C=C1
InChIKey
InChIKey=KXVGYRJBVHYUEA-DEOSSOPVSA-N
Formula
C27H33FN4O3
Mass
480.584
Taxonomic Classification
Taxonomy Tree
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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
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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
Direct Parent
N-acyl-alpha amino acids and derivatives
Alternative Parents
Alpha amino acid amides Indolecarboxamides and derivatives Aminophenyl ethers Methoxyanilines Indoles 2-heteroaryl carboxamides Pyrrole carboxamides Phenylalkylamines Phenoxy compounds Methoxybenzenes Anisoles Alkyl aryl ethers Secondary alkylarylamines Substituted pyrroles Aryl fluorides Fatty amides Heteroaromatic compounds Secondary carboxylic acid amides Azacyclic compounds Hydrocarbon derivatives Organic oxides Carbonyl compounds Organofluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Indolecarboxamide derivative - Indolecarboxylic acid derivative - Aminophenyl ether - Indole - Indole or derivatives - Methoxyaniline - 2-heteroaryl carboxamide - Anisole - Phenoxy compound - Phenol ether - Pyrrole-2-carboxamide - Pyrrole-2-carboxylic acid or derivatives - Aniline or substituted anilines - Phenylalkylamine - Methoxybenzene - Alkyl aryl ether - Secondary aliphatic/aromatic amine - Monocyclic benzene moiety - Aryl halide - Fatty acyl - Benzenoid - Substituted pyrrole - Fatty amide - Aryl fluoride - Pyrrole - Heteroaromatic compound - Secondary carboxylic acid amide - Carboxamide group - Ether - Azacycle - Secondary amine - Organoheterocyclic compound - Organic oxygen compound - Amine - Organic nitrogen compound - Organohalogen compound - Organofluoride - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as n-acyl-alpha amino acids and derivatives. These are compounds containing an alpha amino acid (or a derivative thereof) which bears an acyl group at its terminal nitrogen atom.
External Descriptors
Not available