Compound Identification
SMILES
CCOC(=O)[C@H](CC1=CC=CC=C1)NCC1=CC(CN2CCN(CC2)C2=CC=CC=N2)=C(O)C(OC)=C1
InChIKey
InChIKey=VFVPXWMSDSOJTP-VWLOTQADSA-N
Formula
C29H36N4O4
Mass
504.631
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
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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 esters N-arylpiperazines Pyridinylpiperazines Amphetamines and derivatives Methoxyphenols Methoxybenzenes Benzylamines Anisoles Dialkylarylamines Phenylmethylamines Phenoxy compounds Alkyl aryl ethers N-alkylpiperazines Aminopyridines and derivatives Aralkylamines Fatty acid esters Imidolactams Heteroaromatic compounds Carboxylic acid esters Trialkylamines Azacyclic compounds Dialkylamines Monocarboxylic acids and derivatives Hydrocarbon derivatives Organic oxides Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenylalanine or derivatives - Alpha-amino acid ester - Pyridinylpiperazine - N-arylpiperazine - Amphetamine or derivatives - Methoxyphenol - Phenoxy compound - Phenylmethylamine - Anisole - Benzylamine - Methoxybenzene - Dialkylarylamine - Phenol ether - Aralkylamine - Phenol - Fatty acid ester - N-alkylpiperazine - Aminopyridine - Alkyl aryl ether - Monocyclic benzene moiety - 1,4-diazinane - Fatty acyl - Imidolactam - Benzenoid - Piperazine - Pyridine - Heteroaromatic compound - Tertiary amine - Tertiary aliphatic amine - Carboxylic acid ester - Secondary amine - Monocarboxylic acid or derivatives - Azacycle - Organoheterocyclic compound - Secondary aliphatic amine - Ether - Organic nitrogen compound - Organic oxide - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Hydrocarbon derivative - Amine - 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