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)NCCC1=CNC2=CC=CC=C12
InChIKey
InChIKey=ZRDQFWRSRPZOSQ-GMHMEAMDSA-J
Formula
C33H44N9O17P3S
Mass
963.74
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 Beta amino acids and derivatives Glycosylamines 3-alkylindoles 6-aminopurines Monosaccharide phosphates Organic pyrophosphates Aminopyrimidines and derivatives Substituted pyrroles Alkyl phosphates Benzenoids Imidolactams N-acyl amines N-substituted imidazoles Heteroaromatic compounds Oxolanes Secondary alcohols Secondary carboxylic acid amides Dialkylthioethers Oxacyclic compounds Azacyclic compounds Sulfenyl compounds Hydrocarbon derivatives Primary amines Carbonyl compounds Organic oxides Organic anions
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 - Beta amino acid or derivatives - Glycosyl compound - N-glycosyl compound - 6-aminopurine - Monosaccharide phosphate - Organic pyrophosphate - 3-alkylindole - Imidazopyrimidine - Indole - Indole or derivatives - Purine - Aminopyrimidine - Imidolactam - Benzenoid - Fatty amide - Alkyl phosphate - Monosaccharide - N-acyl-amine - N-substituted imidazole - Organic phosphoric acid derivative - Phosphoric acid ester - Fatty acyl - Substituted pyrrole - Pyrimidine - Oxolane - Pyrrole - Azole - Imidazole - Heteroaromatic compound - Secondary carboxylic acid amide - Secondary alcohol - Carboxamide group - Amino acid or derivatives - Carboxylic acid derivative - Organoheterocyclic compound - Azacycle - Thioether - Sulfenyl compound - Oxacycle - Dialkylthioether - Organosulfur compound - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Carbonyl group - Primary amine - Alcohol - Organic nitrogen compound - Amine - Organic oxygen compound - Organonitrogen compound - Organic anion - 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