Compound Identification
SMILES
CCCCCCCCCCCCCCC\C=C(/F)C(O)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
InChIKey
InChIKey=IBTNAKRUJMSHLK-OFEXHNJOSA-N
Formula
C41H71FN7O18P3S
Mass
1094.03
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Lipids and lipid-like molecules
-
Class
Fatty Acyls
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Subclass
Fatty acyl thioesters
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Level 5
Acyl CoAs
- Level 6 Long-chain fatty acyl CoAs
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Level 5
Acyl CoAs
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Subclass
Fatty acyl thioesters
-
Class
Fatty Acyls
-
Superclass
Lipids and lipid-like molecules
Kingdom
Organic compounds
Superclass
Lipids and lipid-like molecules
Class
Fatty Acyls
Subclass
Fatty acyl thioesters
Intermediate Tree Nodes
Acyl CoAs
Direct Parent
Long-chain fatty acyl CoAs
Alternative Parents
3-hydroxyacyl CoAs Coenzyme A and derivatives Purine ribonucleoside diphosphates Pentose phosphates Ribonucleoside 3'-phosphates Glycosylamines Beta amino acids and derivatives 6-aminopurines Organic pyrophosphates Monosaccharide phosphates Aminopyrimidines and derivatives Monoalkyl phosphates N-substituted imidazoles N-acyl amines Imidolactams Oxolanes Heteroaromatic compounds Carbothioic S-esters Thioesters Fluorohydrins Secondary carboxylic acid amides Secondary alcohols Vinyl fluorides Sulfenyl compounds Azacyclic compounds Oxacyclic compounds Fluoroalkenes Carbonyl compounds Organofluorides Organic oxides Primary amines Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Coenzyme a or derivatives - Purine ribonucleoside 3',5'-bisphosphate - Purine ribonucleoside bisphosphate - Purine ribonucleoside diphosphate - Pentose phosphate - Ribonucleoside 3'-phosphate - Pentose-5-phosphate - Beta amino acid or derivatives - Glycosyl compound - N-glycosyl compound - Pentose monosaccharide - Organic pyrophosphate - 6-aminopurine - Monosaccharide phosphate - Purine - Imidazopyrimidine - Aminopyrimidine - Monoalkyl phosphate - Imidolactam - Phosphoric acid ester - Organic phosphoric acid derivative - N-substituted imidazole - Fatty amide - Monosaccharide - N-acyl-amine - Pyrimidine - Alkyl phosphate - Azole - Oxolane - Heteroaromatic compound - Imidazole - Amino acid or derivatives - Carbothioic s-ester - Carboxamide group - Fluorohydrin - Halohydrin - Thiocarboxylic acid ester - Secondary carboxylic acid amide - Secondary alcohol - Haloalkene - Oxacycle - Sulfenyl compound - Fluoroalkene - Thiocarboxylic acid or derivatives - Carboxylic acid derivative - Vinyl fluoride - Organoheterocyclic compound - Vinyl halide - Azacycle - Organic oxygen compound - Alcohol - Amine - Organic nitrogen compound - Organohalogen compound - Carbonyl group - Hydrocarbon derivative - Primary amine - Organofluoride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as long-chain fatty acyl coas. These are acyl CoAs where the group acylated to the coenzyme A moiety is a long aliphatic chain of 13 to 21 carbon atoms.
External Descriptors
Not available