Compound Identification
SMILES
O=C(C[C@@H]1CCNC[C@@H]1CC1=NOC(CN2CCN(CC2)C2=CC=CC=C2)=C1)N1CCN(CC1)C1=CC=CC=N1
InChIKey
InChIKey=DJXKTGKWFAHSBP-UIOOFZCWSA-N
Formula
C31H41N7O2
Mass
543.716
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
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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
Delta amino acids and derivatives
Alternative Parents
Pyridinylpiperazines Phenylpiperazines N-arylpiperazines Aniline and substituted anilines Dialkylarylamines Aminopyridines and derivatives Aralkylamines N-alkylpiperazines Piperidines Imidolactams Tertiary carboxylic acid amides Heteroaromatic compounds Isoxazoles Trialkylamines Dialkylamines Azacyclic compounds Oxacyclic compounds Organic oxides Carbonyl compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Delta amino acid or derivatives - Phenylpiperazine - Pyridinylpiperazine - N-arylpiperazine - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Aniline or substituted anilines - Aminopyridine - N-alkylpiperazine - Aralkylamine - Monocyclic benzene moiety - Imidolactam - Benzenoid - 1,4-diazinane - Piperazine - Piperidine - Pyridine - Azole - Heteroaromatic compound - Isoxazole - Tertiary carboxylic acid amide - Tertiary amine - Tertiary aliphatic amine - Carboxamide group - Azacycle - Secondary amine - Organoheterocyclic compound - Secondary aliphatic amine - Oxacycle - Organic oxide - Organic nitrogen compound - Amine - Carbonyl group - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as delta amino acids and derivatives. These are compounds containing a carboxylic acid group and an amino group at the C5 carbon atom.
External Descriptors
Not available