Compound Identification
SMILES
CCCCC(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.CCC(O)CCSCCNC(=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=VTDSWQUXZRGYHW-XMOWHRPOSA-N
Formula
C52H92N14O34P6S2
Mass
1707.33
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 6-aminopurines Organic pyrophosphates Monosaccharide phosphates Aminopyrimidines and derivatives Monoalkyl phosphates Imidolactams N-acyl amines N-substituted imidazoles Heteroaromatic compounds Oxolanes Secondary alcohols Secondary carboxylic acid amides Oxacyclic compounds Sulfenyl compounds Dialkylthioethers Azacyclic compounds Hydrocarbon derivatives Primary amines Carbonyl compounds Organic oxides
Molecular Framework
Not available
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 - Organic pyrophosphate - Monosaccharide phosphate - 6-aminopurine - Imidazopyrimidine - Purine - Aminopyrimidine - Monoalkyl phosphate - Alkyl phosphate - Organic phosphoric acid derivative - Imidolactam - Monosaccharide - Fatty acyl - N-acyl-amine - Fatty amide - Phosphoric acid ester - Pyrimidine - N-substituted imidazole - Oxolane - Heteroaromatic compound - Azole - Imidazole - Carboxamide group - Secondary carboxylic acid amide - Amino acid or derivatives - Secondary alcohol - Azacycle - Dialkylthioether - Organoheterocyclic compound - Sulfenyl compound - Thioether - Oxacycle - Carboxylic acid derivative - Organic nitrogen compound - Primary amine - Carbonyl group - Hydrocarbon derivative - Organic oxide - Alcohol - Amine - Organic oxygen compound - Organosulfur compound - Organooxygen compound - Organonitrogen 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