Structure Information
Structure

Compound Identification

SMILES

[H]C(C)(CCC(=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)C1([H])CCC2([H])C3([H])CCC4=CC(=O)CCC4(C)C3([H])CCC12C

InChIKey

InChIKey=VVQGMUPGBRZRFY-UHFFFAOYSA-N

Formula

C45H70N7O18P3S

Mass

1122.07

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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

2,3,4-saturated 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 - Steroidal glycoside - Bile acid, alcohol, or derivatives - 3-oxo-delta-4-steroid - 3-oxosteroid - Oxosteroid - Delta-4-steroid - Steroid - Ribonucleoside 3'-phosphate - Pentose phosphate - Pentose-5-phosphate - Glycosyl compound - N-glycosyl compound - 6-aminopurine - Organic pyrophosphate - Monosaccharide phosphate - Pentose monosaccharide - Purine - Imidazopyrimidine - Monoalkyl phosphate - Aminopyrimidine - Cyclohexenone - Alkyl phosphate - Monosaccharide - N-substituted imidazole - Organic phosphoric acid derivative - Pyrimidine - Imidolactam - Phosphoric acid ester - Azole - Oxolane - Heteroaromatic compound - Imidazole - Ketone - Carbothioic s-ester - Cyclic ketone - Thiocarboxylic acid ester - Amino acid or derivatives - Secondary alcohol - Sulfenyl compound - Thiocarboxylic acid or derivatives - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organoheterocyclic compound - Carboximidic acid - Carboximidic acid derivative - Carboxylic acid derivative - Azacycle - Oxacycle - Alcohol - Carbonyl group - Amine - Primary amine - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 2,3,4-saturated fatty acyl coas. These are acyl-CoAs carrying a 2,3,4-saturated fatty acyl chain.

External Descriptors

Not available

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