Structure Information
Structure

Compound Identification

SMILES

CC(C)(COP(O)(=O)OP(O)(=O)OC[C@@H]1O[C@@H]([C@H](O)[C@@H]1OP(O)(O)=O)n1cnc2c(N)ncnc12)C(O)C(=O)NCCC(=O)NCCSC(=O)C[C@H](O)CCC\C=C/C=C/C=C/[C@H](SC[C@H](N)C(O)=O)[C@H](O)CCCC(O)=O

InChIKey

InChIKey=APLMMNVXTIRDHJ-IPODHEAQSA-N

Formula

C42H67N8O23P3S2

Mass

1209.07

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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 - 3-hydroxyacyl CoAs - (R)-3-hydroxyacyl CoAs

Direct Parent

Long-chain (3R)-3-hydroxyacyl 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 - Octadecanoid - Long-chain fatty acid - L-cysteine-s-conjugate - Cysteine or derivatives - Beta amino acid or derivatives - Glycosyl compound - N-glycosyl compound - Alpha-amino acid or derivatives - 6-aminopurine - Alpha-amino acid - Monosaccharide phosphate - Organic pyrophosphate - Pentose monosaccharide - L-alpha-amino acid - Imidazopyrimidine - Purine - Aminopyrimidine - Monoalkyl phosphate - Hydroxy fatty acid - Thia fatty acid - Fatty acid - Imidolactam - Dicarboxylic acid or derivatives - Fatty amide - Alkyl phosphate - Unsaturated fatty acid - Monosaccharide - N-acyl-amine - N-substituted imidazole - Organic phosphoric acid derivative - Phosphoric acid ester - Pyrimidine - Heteroaromatic compound - Oxolane - Imidazole - Azole - Secondary alcohol - Carboxamide group - Secondary carboxylic acid amide - Thiocarboxylic acid ester - Amino acid - Amino acid or derivatives - Carbothioic s-ester - Thioether - Sulfenyl compound - Azacycle - Thiocarboxylic acid or derivatives - Dialkylthioether - Carboxylic acid derivative - Organoheterocyclic compound - Oxacycle - Carboxylic acid - Primary amine - Organic nitrogen compound - Alcohol - Organooxygen compound - Organic oxide - Amine - Organosulfur compound - Carbonyl group - Organopnictogen compound - Primary aliphatic amine - Hydrocarbon derivative - Organonitrogen compound - Organic oxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as long-chain (3r)-3-hydroxyacyl coas. These are organic compounds containing a (R)-3-hydroxyl acylated coenzyme A derivative, to which the acyl chain carries between 13 and 21 carbon atoms.

External Descriptors

Not available

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