Compound Identification
SMILES
CCCCC1(CC)CN(C2=CC=CC=C2)C2=CC(Br)=C(OCC(=O)N[C@@H](CC3=CC=CC=C3)C(=O)OCC)C=C2S(=O)(=O)C1
InChIKey
InChIKey=UTRMZCFBRDTDRN-GZMKETDRSA-N
Formula
C34H41BrN2O6S
Mass
685.67
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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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 Phenylalanine and derivatives
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Level 6
Alpha amino acids and derivatives
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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
Direct Parent
Phenylalanine and derivatives
Alternative Parents
Alpha amino acid esters N-acyl-alpha amino acids and derivatives Alkyldiarylamines Benzothiazepines Amphetamines and derivatives Phenol ethers Aniline and substituted anilines Fatty acid esters Alkyl aryl ethers Aryl bromides Sulfones Carboxylic acid esters Secondary carboxylic acid amides Azacyclic compounds Monocarboxylic acids and derivatives Hydrocarbon derivatives Carbonyl compounds Organobromides Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenylalanine or derivatives - N-acyl-alpha amino acid or derivatives - Alpha-amino acid ester - Alkyldiarylamine - Benzothiazepine - Amphetamine or derivatives - Phenol ether - Tertiary aliphatic/aromatic amine - Aniline or substituted anilines - Alkyl aryl ether - Fatty acid ester - Benzenoid - Aryl halide - Monocyclic benzene moiety - Aryl bromide - Fatty acyl - Sulfone - Tertiary amine - Secondary carboxylic acid amide - Carboxylic acid ester - Carboxamide group - Organoheterocyclic compound - Ether - Monocarboxylic acid or derivatives - Azacycle - Organic nitrogen compound - Organohalogen compound - Carbonyl group - Organobromide - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Amine - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phenylalanine and derivatives. These are compounds containing phenylalanine or a derivative thereof resulting from reaction of phenylalanine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.
External Descriptors
Not available