Compound Identification
SMILES
CC\C(CC\C=C(/C)CCC(=O)C[C@H](O)[C@@H](C)[C@H](O)[C@@H](C)[C@@H](O)[C@H](C)C(=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@@H](C)C\C=C\[C@@H](C)C[C@@H](C)C(C)=O
InChIKey
InChIKey=ISCOHRXMKJSXGT-DOIMXYIESA-N
Formula
C56H94N7O22P3S
Mass
1342.38
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Fatty Acyls
-
Subclass
Fatty acyl thioesters
-
Level 5
Acyl CoAs
-
Level 6
3-hydroxyacyl CoAs
- Level 7 (R)-3-hydroxyacyl CoAs
-
Level 6
3-hydroxyacyl CoAs
-
Level 5
Acyl CoAs
-
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 - 3-hydroxyacyl CoAs - (R)-3-hydroxyacyl CoAs
Direct Parent
Very-long-chain (3R)-3-hydroxyacyl CoAs
Alternative Parents
Very long-chain fatty acyl CoAs 2,3,4-saturated fatty acyl CoAs Coenzyme A and derivatives Purine ribonucleoside diphosphates Ribonucleoside 3'-phosphates Pentose phosphates Beta amino acids and derivatives Glycosylamines 6-aminopurines Aromatic monoterpenoids Bicyclic monoterpenoids Organic pyrophosphates Monosaccharide phosphates Aminopyrimidines and derivatives Monoalkyl phosphates Beta-hydroxy ketones Imidolactams N-acyl amines N-substituted imidazoles Heteroaromatic compounds Oxolanes Thioesters Secondary carboxylic acid amides Secondary alcohols Carbothioic S-esters Polyols Azacyclic compounds Oxacyclic compounds Sulfenyl compounds Primary amines Organic oxides 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 - Pentose-5-phosphate - Ribonucleoside 3'-phosphate - N-glycosyl compound - Glycosyl compound - Beta amino acid or derivatives - Monosaccharide phosphate - Monoterpenoid - Bicyclic monoterpenoid - Organic pyrophosphate - 6-aminopurine - Pentose monosaccharide - Aromatic monoterpenoid - Imidazopyrimidine - Purine - Monoalkyl phosphate - Aminopyrimidine - Beta-hydroxy ketone - Imidolactam - Monosaccharide - Alkyl phosphate - N-acyl-amine - N-substituted imidazole - Organic phosphoric acid derivative - Phosphoric acid ester - Fatty amide - Pyrimidine - Oxolane - Imidazole - Azole - Heteroaromatic compound - Carboxamide group - Ketone - Secondary carboxylic acid amide - Amino acid or derivatives - Secondary alcohol - Carbothioic s-ester - Thiocarboxylic acid ester - Oxacycle - Azacycle - Organoheterocyclic compound - Sulfenyl compound - Thiocarboxylic acid or derivatives - Carboxylic acid derivative - Polyol - Carbonyl group - Organic oxygen compound - Amine - Alcohol - Organic nitrogen compound - Organic oxide - Primary amine - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as very-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 at least 22 carbon atoms.
External Descriptors
Not available