Structure Information
Structure

Compound Identification

SMILES

CCCCCC=CCC=CCCCCCCCCCC(=O)SCCNC(O)C(CNC(=O)C(O)C(C)(C)COP(O)(=O)OP(O)(=O)OCC1OC(C(O)C1OP(O)(O)=O)N1C=NC2=C1N=CN=C2N)C(O)=O

InChIKey

InChIKey=BDIFDRGVARSPBO-UHFFFAOYSA-N

Formula

C42H72N7O19P3S

Mass

1104.05

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Fatty Acyls

Subclass

Fatty acyl thioesters

Intermediate Tree Nodes

Acyl CoAs

Direct Parent

Long-chain fatty acyl CoAs

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Coenzyme a or derivatives - Purine ribonucleoside 3',5'-bisphosphate - Purine ribonucleoside bisphosphate - Purine ribonucleoside diphosphate - Pentose phosphate - Ribonucleoside 3'-phosphate - Pentose-5-phosphate - Beta amino acid or derivatives - Glycosyl compound - N-glycosyl compound - 6-aminopurine - Organic pyrophosphate - Pentose monosaccharide - Monosaccharide phosphate - Purine - Imidazopyrimidine - Beta-hydroxy acid - Monoalkyl phosphate - Aminopyrimidine - Alkyl phosphate - Phosphoric acid ester - Organic phosphoric acid derivative - Fatty amide - Monosaccharide - N-acyl-amine - N-substituted imidazole - Pyrimidine - Hydroxy acid - Imidolactam - Heteroaromatic compound - Imidazole - Azole - Tetrahydrofuran - Amino acid or derivatives - Amino acid - Carboxamide group - Hemiaminal - Carbothioic s-ester - Thiocarboxylic acid ester - Secondary carboxylic acid amide - Secondary alcohol - Secondary amine - Thiocarboxylic acid or derivatives - Alkanolamine - Carboxylic acid derivative - Carboxylic acid - Secondary aliphatic amine - Oxacycle - Azacycle - Organoheterocyclic compound - Sulfenyl compound - Monocarboxylic acid or derivatives - Primary amine - Organosulfur compound - Organopnictogen compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organic oxide - Amine - Organic nitrogen compound - Alcohol - Organic oxygen compound - Carbonyl group - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as long-chain fatty acyl coas. These are acyl CoAs where the group acylated to the coenzyme A moiety is a long aliphatic chain of 13 to 21 carbon atoms.

External Descriptors

Not available

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