Compound Identification
SMILES
CN1CCC(CC1)NC(CC1=CC=CC=C1)C(=O)NC1=CC=C(S1)C1=CC=C(C=C1)N1CCN(C)CC1
InChIKey
InChIKey=DNXKWWDBGXLFNA-UHFFFAOYSA-N
Formula
C30H39N5OS
Mass
517.74
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
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Subclass
Amino acids, peptides, and analogues
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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 amides Phenylpiperazines N-arylpiperazines Amphetamines and derivatives Aniline and substituted anilines Dialkylarylamines N-arylamides 2,5-disubstituted thiophenes Aminopiperidines Aralkylamines N-methylpiperazines Fatty amides Heteroaromatic compounds Trialkylamines Secondary carboxylic acid amides Dialkylamines Azacyclic compounds Carbonyl compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenylalanine or derivatives - Alpha-amino acid amide - Phenylpiperazine - N-arylpiperazine - Amphetamine or derivatives - Tertiary aliphatic/aromatic amine - N-arylamide - Aniline or substituted anilines - Dialkylarylamine - 4-aminopiperidine - N-methylpiperazine - Aralkylamine - N-alkylpiperazine - 2,5-disubstituted thiophene - Monocyclic benzene moiety - 1,4-diazinane - Fatty amide - Piperazine - Piperidine - Fatty acyl - Benzenoid - Heteroaromatic compound - Thiophene - Secondary carboxylic acid amide - Tertiary aliphatic amine - Tertiary amine - Carboxamide group - Secondary amine - Organoheterocyclic compound - Azacycle - Secondary aliphatic amine - Carbonyl group - Amine - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Aromatic heteromonocyclic 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