Structure Information
Structure

Compound Identification

SMILES

CC(=O)CC[C@H](CC(=O)SCCNC(=O)CCNC(=O)[C@H](O)C(C)(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(C)=C

InChIKey

InChIKey=VMTHAXKUEKKCEY-PDQACDDGSA-N

Formula

C31H50N7O18P3S

Mass

933.75

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

CHEBI:29004 : oxo-fatty acyl-CoA - unsaturated fatty acyl-CoA - branched-chain fatty acyl-CoA

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