Structure Information
Structure

Compound Identification

SMILES

[H]C(CCCCCC)=C([H])C([H])=C([H])CC([H])=C([H])C(=O)SCCN=C(O)CCN=C(O)C([H])(O)C(C)(C)COP(O)(=O)OP(O)(=O)OCC1([H])OC([H])(N2C=NC3=C(N)N=CN=C23)C([H])(O)C1([H])OP(O)(O)=O

InChIKey

InChIKey=XPVHXTGUZGACRU-UHFFFAOYSA-N

Formula

C35H56N7O17P3S

Mass

971.85

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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 - Long-chain enoyl CoAs

Direct Parent

Long-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 - Ribonucleoside 3'-phosphate - Pentose phosphate - Pentose-5-phosphate - Glycosyl compound - N-glycosyl compound - 6-aminopurine - Monosaccharide phosphate - Organic pyrophosphate - Pentose monosaccharide - Purine - Imidazopyrimidine - Monoalkyl phosphate - Aminopyrimidine - Alkyl phosphate - Imidolactam - Organic phosphoric acid derivative - N-substituted imidazole - Monosaccharide - Pyrimidine - Phosphoric acid ester - Oxolane - Heteroaromatic compound - Azole - Imidazole - Carbothioic s-ester - Amino acid or derivatives - Thiocarboxylic acid ester - Secondary alcohol - Sulfenyl compound - Thiocarboxylic acid or derivatives - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Organoheterocyclic compound - Azacycle - Carboximidic acid - Carboximidic acid derivative - Carboxylic acid derivative - Oxacycle - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Carbonyl group - Primary amine - Alcohol - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Amine - Organonitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as long-chain 2-enoyl coas. These are organic compounds containing a coenzyme A substructure linked to a long-chain 2-enoyl chain of 13 to 21 carbon atoms.

External Descriptors

Not available

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