Structure Information
Structure

Compound Identification

SMILES

CC(C)(COP(O)(=O)OP(O)(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1OP(O)(O)=O)N1C=NC2=C1N=CN=C2N)[C@@H](O)C(=O)NCCC(=O)NCCSC(=O)CC(=O)CCCC([O-])=O

InChIKey

InChIKey=KJXFOFKTZDJLMQ-UYRKPTJQSA-M

Formula

C28H43N7O20P3S

Mass

922.66

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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

3-oxo-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 - Monosaccharide phosphate - Organic pyrophosphate - Pentose monosaccharide - Imidazopyrimidine - Purine - Medium-chain fatty acid - Monoalkyl phosphate - Hydroxy fatty acid - Aminopyrimidine - 1,3-dicarbonyl compound - Imidolactam - Alkyl phosphate - Monosaccharide - N-acyl-amine - Pyrimidine - Fatty acid - N-substituted imidazole - Organic phosphoric acid derivative - Phosphoric acid ester - Fatty amide - Heteroaromatic compound - Imidazole - Azole - Oxolane - Amino acid - Thiocarboxylic acid ester - Carbothioic s-ester - Amino acid or derivatives - Ketone - Secondary carboxylic acid amide - Secondary alcohol - Carboxylic acid salt - Carboxamide group - Sulfenyl compound - Thiocarboxylic acid or derivatives - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Carboxylic acid - Oxacycle - Monocarboxylic acid or derivatives - Organic oxygen compound - Primary amine - Organic oxide - Carbonyl group - Organic nitrogen compound - Organosulfur compound - Alcohol - Amine - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic anion - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 3-oxo-acyl coas. These are organic compounds containing a 3-oxo acylated coenzyme A derivative.

External Descriptors

Not available

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