Structure Information
Structure

Compound Identification

SMILES

CCNC1=NC(CCCCCC[C@@H](CC(O)=O)C2=CN=C(OC)N=C2)=CC(N)=N1

InChIKey

InChIKey=PUAXFUCQWQYYSP-AWEZNQCLSA-N

Formula

C20H30N6O3

Mass

402.499

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Fatty Acyls

Subclass

Fatty acids and conjugates

Intermediate Tree Nodes

Not available

Direct Parent

Medium-chain fatty acids

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Medium-chain fatty acid - Alkyl aryl ether - Amino fatty acid - Aminopyrimidine - Heterocyclic fatty acid - Imidolactam - Pyrimidine - Heteroaromatic compound - Amino acid or derivatives - Amino acid - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Carboxylic acid - Ether - Monocarboxylic acid or derivatives - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Primary amine - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Amine - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as medium-chain fatty acids. These are fatty acids with an aliphatic tail that contains between 4 and 12 carbon atoms.

External Descriptors

Not available

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