Compound Identification
SMILES
COC1=CC=C(CC(N)C(=O)NC2CCC(C2O)N2C=NC3=C2N=CN=C3N(C)C)C=C1
InChIKey
InChIKey=IYENWKKNJMYMDM-UHFFFAOYSA-N
Formula
C22H29N7O3
Mass
439.52
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
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
-
Level 6
Alpha amino acids and derivatives
-
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 6-alkylaminopurines Amphetamines and derivatives Phenoxy compounds Anisoles Dialkylarylamines Methoxybenzenes Aralkylamines Alkyl aryl ethers Aminopyrimidines and derivatives Imidolactams Fatty amides Cyclopentanols N-substituted imidazoles Heteroaromatic compounds Secondary carboxylic acid amides Cyclic alcohols and derivatives Azacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organopnictogen compounds Monoalkylamines Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenylalanine or derivatives - Alpha-amino acid amide - 6-alkylaminopurine - 6-aminopurine - Amphetamine or derivatives - Imidazopyrimidine - Purine - Phenoxy compound - Anisole - Phenol ether - Dialkylarylamine - Methoxybenzene - Aralkylamine - Alkyl aryl ether - Aminopyrimidine - Imidolactam - Benzenoid - Cyclopentanol - Fatty amide - Pyrimidine - Fatty acyl - N-substituted imidazole - Monocyclic benzene moiety - Cyclic alcohol - Heteroaromatic compound - Imidazole - Azole - Secondary carboxylic acid amide - Secondary alcohol - Carboxamide group - Organoheterocyclic compound - Azacycle - Ether - Hydrocarbon derivative - Organopnictogen compound - Carbonyl group - Primary aliphatic amine - Organonitrogen compound - Alcohol - Organic oxygen compound - Organooxygen compound - Organic nitrogen compound - Primary amine - Amine - Organic oxide - 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