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)N1C=NC2=C1N=CN=C2N)[C@@H](O)C(=O)NCCC(=O)NCCSCC(=O)C1=CC=C(Cl)C=C1
InChIKey
InChIKey=JKZHFXZXNBMAGG-VXAHOBLNSA-N
Formula
C29H41ClN7O17P3S
Mass
920.11
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
- Class S-alkyl-CoAs
-
Superclass
Lipids and lipid-like molecules
Kingdom
Organic compounds
Superclass
Lipids and lipid-like molecules
Class
S-alkyl-CoAs
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
S-alkyl-CoAs
Alternative Parents
Coenzyme A and derivatives Purine ribonucleoside diphosphates Ribonucleoside 3'-phosphates Pentose phosphates Alkyl-phenylketones Beta amino acids and derivatives Glycosylamines 6-aminopurines Organic pyrophosphates Monosaccharide phosphates Aryl alkyl ketones Benzoyl derivatives Aminopyrimidines and derivatives Chlorobenzenes Monoalkyl phosphates Imidolactams Aryl chlorides N-acyl amines N-substituted imidazoles Heteroaromatic compounds Oxolanes Secondary carboxylic acid amides Secondary alcohols Sulfenyl compounds Dialkylthioethers Oxacyclic compounds Azacyclic compounds Hydrocarbon derivatives Organochlorides Primary amines Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Coenzyme a or derivatives - Purine ribonucleoside diphosphate - Purine ribonucleoside bisphosphate - Purine ribonucleoside 3',5'-bisphosphate - Ribonucleoside 3'-phosphate - Pentose-5-phosphate - Pentose phosphate - Alkyl-phenylketone - Beta amino acid or derivatives - N-glycosyl compound - Glycosyl compound - Monosaccharide phosphate - Organic pyrophosphate - Pentose monosaccharide - 6-aminopurine - Imidazopyrimidine - Purine - Phenylketone - Aryl alkyl ketone - Aryl ketone - Benzoyl - Halobenzene - Monoalkyl phosphate - Aminopyrimidine - Chlorobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Fatty amide - Fatty acyl - Imidolactam - Monosaccharide - N-acyl-amine - N-substituted imidazole - Organic phosphoric acid derivative - Benzenoid - Alkyl phosphate - Phosphoric acid ester - Pyrimidine - Azole - Imidazole - Oxolane - Heteroaromatic compound - Carboxamide group - Secondary alcohol - Secondary carboxylic acid amide - Ketone - Amino acid or derivatives - Thioether - Dialkylthioether - Sulfenyl compound - Organoheterocyclic compound - Azacycle - Oxacycle - Carboxylic acid derivative - Amine - Organic oxide - Organochloride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Carbonyl group - Primary amine - Alcohol - Organohalogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as s-alkyl-coas. These are alkyl sulfides consisting of coenzyme A that carries an S-alkyl substituent.
External Descriptors
Not available