Compound Identification
SMILES
O=C1CN(CC2=CN=CN2CC2=CC=C(C=C2)C#N)CCN1CCC12CC3CC(CC(C3)C1)C2
InChIKey
InChIKey=UQHUIBMVRUUDLS-UHFFFAOYSA-N
Formula
C28H35N5O
Mass
457.622
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
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
-
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
Direct Parent
Alpha amino acids and derivatives
Alternative Parents
Benzonitriles N-alkylpiperazines Aralkylamines N-substituted imidazoles Tertiary carboxylic acid amides Heteroaromatic compounds Trialkylamines Lactams Nitriles Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid or derivatives - Benzonitrile - N-alkylpiperazine - Aralkylamine - N-substituted imidazole - Monocyclic benzene moiety - Piperazine - 1,4-diazinane - Benzenoid - Azole - Tertiary carboxylic acid amide - Heteroaromatic compound - Imidazole - Lactam - Tertiary aliphatic amine - Carboxamide group - Tertiary amine - Azacycle - Organoheterocyclic compound - Carbonitrile - Nitrile - Amine - Organic nitrogen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Cyanide - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as alpha amino acids and derivatives. These are amino acids in which the amino group is attached to the carbon atom immediately adjacent to the carboxylate group (alpha carbon), or a derivative thereof.
External Descriptors
Not available