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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\CC[C@H](N)C(O)=O

InChIKey

InChIKey=ONEMMXGQZFHUNC-XRKYVJQNSA-N

Formula

C29H47N8O19P3S

Mass

936.71

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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 - Pentose-5-phosphate - Ribonucleoside 3'-phosphate - Beta amino acid or derivatives - C-glycosyl compound - Glycosyl compound - Pentose monosaccharide - L-alpha-amino acid - 6-aminopurine - Monosaccharide phosphate - Organic pyrophosphate - Alpha-amino acid or derivatives - Alpha-amino acid - Purine - Imidazopyrimidine - Medium-chain fatty acid - Aminopyrimidine - Hydroxy fatty acid - Monoalkyl phosphate - Fatty amide - Fatty acid - Imidolactam - Monosaccharide - N-acyl-amine - N-substituted imidazole - Organic phosphoric acid derivative - Alkyl phosphate - Unsaturated fatty acid - Phosphoric acid ester - Pyrimidine - Heteroaromatic compound - Azole - Oxolane - Imidazole - Secondary alcohol - Secondary carboxylic acid amide - Carbothioic s-ester - Amino acid - Amino acid or derivatives - Carboxamide group - Thiocarboxylic acid ester - Organoheterocyclic compound - Sulfenyl compound - Monocarboxylic acid or derivatives - Azacycle - Thiocarboxylic acid or derivatives - Oxacycle - Carboxylic acid - Carboxylic acid derivative - Organosulfur compound - Organic nitrogen compound - Carbonyl group - Alcohol - Primary aliphatic amine - Organic oxygen compound - Hydrocarbon derivative - Primary amine - Organic oxide - Amine - Organonitrogen compound - Organooxygen compound - 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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