Structure Information
Structure

Compound Identification

SMILES

CC1=NC=C(N=C1)C(=O)N(CCCN1CCOCC1)CCC(=O)N1CCN(CC=CC2=CC=CC=C2)CC1

InChIKey

InChIKey=SITZYWAJKRXEBT-UHFFFAOYSA-N

Formula

C29H40N6O3

Mass

520.678

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Taxonomic Classification

Taxonomy Tree

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

Beta amino acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Beta amino acid or derivatives - Pyrazine carboxylic acid or derivatives - Pyrazinecarboxamide - 2-heteroaryl carboxamide - Styrene - N-alkylpiperazine - Monocyclic benzene moiety - Pyrazine - 1,4-diazinane - Benzenoid - Piperazine - Morpholine - Oxazinane - Heteroaromatic compound - Tertiary carboxylic acid amide - Carboxamide group - Tertiary amine - Tertiary aliphatic amine - Dialkyl ether - Ether - Oxacycle - Azacycle - Organoheterocyclic compound - Hydrocarbon derivative - Amine - Organic oxide - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Carbonyl group - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as beta amino acids and derivatives. These are amino acids having a (-NH2) group attached to the beta carbon atom.

External Descriptors

Not available

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