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-N
Formula
C44H53BF2N6O10S2
Mass
938.87
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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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 Monocarboxylic acids and derivatives Azacyclic compounds Organic metalloid salts Propargyl-type 1,3-dipolar organic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Organic zwitterions Amines
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 - Fatty amide - N-acyl-amine - Pyrrolidone - 2-pyrrolidone - Substituted pyrrole - Benzenoid - Fatty acyl - Heteroaromatic compound - Alkanesulfonic acid - Thiophene - Sulfonyl - Organosulfonic acid - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Dicarboximide - Quaternary ammonium salt - Tetraalkylammonium salt - Pyrrole - Pyrrolidine - Carboxamide group - Lactam - Secondary carboxylic acid amide - Azacycle - Organic metalloid salt - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Ether - Monocarboxylic acid or derivatives - Carbonyl group - Hydrocarbon derivative - Organic oxygen compound - Organic salt - Organic zwitterion - Amine - Organic oxide - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic nitrogen compound - 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