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Structure Information
Structure

Compound Identification

SMILES

CC(C)(COP([O-])(=O)OP([O-])(=O)OCC1OC(C)(C(O)C1OP([O-])([O-])=O)N1C=NC2=C1N=CN=C2N)C(O)C(=O)NCCC(=O)NCCSC(=O)\C=C/CCCC(O)=O

InChIKey

InChIKey=AWKKPAFZJORXNU-VURMDHGXSA-J

Formula

C29H42N7O19P3S

Mass

917.67

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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

Enoyl CoAs

Direct Parent

Medium-chain 2-enoyl 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 - C-glycosyl compound - Glycosyl compound - 6-aminopurine - Monosaccharide phosphate - Organic pyrophosphate - Imidazopyrimidine - Purine - Medium-chain fatty acid - Hydroxy fatty acid - Aminopyrimidine - Fatty acid - Fatty amide - Pyrimidine - Organic phosphoric acid derivative - Imidolactam - Monosaccharide - Phosphoric acid ester - N-acyl-amine - N-substituted imidazole - Unsaturated fatty acid - Alkyl phosphate - Oxolane - Azole - Heteroaromatic compound - Imidazole - Thiocarboxylic acid ester - Amino acid or derivatives - Secondary carboxylic acid amide - Carboxamide group - Secondary alcohol - Amino acid - Carbothioic s-ester - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Oxacycle - Sulfenyl compound - Azacycle - Carboxylic acid derivative - Thiocarboxylic acid or derivatives - Carboxylic acid - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Amine - Hydrocarbon derivative - Carbonyl group - Alcohol - Primary amine - Organic oxide - Organic oxygen compound - Organosulfur compound - Organic anion - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as medium-chain 2-enoyl coas. These are organic compounds containing a coenzyme A substructure linked to a medium-chain 2-enoyl chain of 5 to 12 carbon atoms.

External Descriptors

Not available

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