Compound Identification
SMILES
[H]C(C)(N)C(=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
InChIKey
InChIKey=OIKPXGRGSUBNRF-UHFFFAOYSA-N
Formula
C24H41N8O17P3S
Mass
838.61
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
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Class
Fatty Acyls
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Subclass
Fatty acyl thioesters
- Level 5 Acyl CoAs
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Subclass
Fatty acyl thioesters
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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
Not available
Direct Parent
Acyl CoAs
Alternative Parents
Coenzyme A and derivatives Purine ribonucleoside diphosphates Ribonucleoside 3'-phosphates Pentose phosphates Alanine and derivatives Glycosylamines Organic pyrophosphates Monosaccharide phosphates 6-aminopurines Aminopyrimidines and derivatives Monoalkyl phosphates N-substituted imidazoles Imidolactams Heteroaromatic compounds Oxolanes Secondary alcohols Carbothioic S-esters Thioesters Sulfenyl compounds Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Azacyclic compounds Carboximidic acids Organic oxides Carbonyl compounds Monoalkylamines 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 - Glycosyl compound - N-glycosyl compound - Alanine or derivatives - Organic pyrophosphate - Monosaccharide phosphate - Pentose monosaccharide - Alpha-amino acid or derivatives - 6-aminopurine - Imidazopyrimidine - Purine - Aminopyrimidine - Monoalkyl phosphate - Alkyl phosphate - N-substituted imidazole - Monosaccharide - Phosphoric acid ester - Imidolactam - Organic phosphoric acid derivative - Pyrimidine - Oxolane - Azole - Imidazole - Heteroaromatic compound - Thiocarboxylic acid ester - Carbothioic s-ester - Amino acid or derivatives - Secondary alcohol - Oxacycle - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Sulfenyl compound - Carboximidic acid - Carboximidic acid derivative - Carboxylic acid derivative - Thiocarboxylic acid or derivatives - Organic nitrogen compound - Carbonyl group - Amine - Alcohol - Hydrocarbon derivative - Primary amine - Primary aliphatic amine - Organic oxide - Organic oxygen compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as acyl coas. These are organic compounds containing a coenzyme A substructure linked to an acyl chain.
External Descriptors
Not available