Compound Identification
SMILES
CC1=C2C=C3C(CCC[N+](C)(C)C)=CC(C4=CC=CS4)=[N+]3[B-](F)(F)N2C(\C=C\C2=CC=C(OCCCC(=O)NC(CS(O)(=O)=O)C(=O)NCCCCC(=O)ON3C(=O)CCC3=O)C=C2)=C1
InChIKey
InChIKey=RGQUCMMVEGFDJB-SAPNQHFASA-O
Formula
C44H54BF2N6O10S2
Mass
939.87
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
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Class
Carboxylic acids and derivatives
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Subclass
Amino acids, peptides, and analogues
- Level 5 Amino acids and derivatives
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Subclass
Amino acids, peptides, and analogues
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Class
Carboxylic acids and derivatives
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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 Styrenes Phenol ethers Phenoxy compounds Alkyl aryl ethers N-acyl amines Substituted pyrroles Pyrrolidine-2-ones Alkanesulfonic acids Thiophenes Tetraalkylammonium salts Dicarboximides Heteroaromatic compounds Sulfonyls Organosulfonic acids Lactams Secondary carboxylic acid amides Azacyclic compounds Monocarboxylic acids and derivatives Organic metalloid salts Hydrocarbon derivatives Carbonyl compounds Organic oxides Amines Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Phenoxy compound - Phenol ether - Styrene - Alkyl aryl ether - Monocyclic benzene moiety - Pyrrolidone - 2-pyrrolidone - Fatty amide - Fatty acyl - Substituted pyrrole - N-acyl-amine - Benzenoid - Tetraalkylammonium salt - Pyrrole - Pyrrolidine - Alkanesulfonic acid - Thiophene - Sulfonyl - Organosulfonic acid - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Dicarboximide - Quaternary ammonium salt - Heteroaromatic compound - Secondary carboxylic acid amide - Carboxamide group - Lactam - Azacycle - Ether - Organic metalloid salt - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Organic oxide - Amine - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Carbonyl group - Organic salt - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic cation - 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