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)NCCSC(=O)CC(=O)C1=CC=CC=C1
InChIKey
InChIKey=NHDPIYICCBKNNJ-FUEUKBNZSA-N
Formula
C30H42N7O18P3S
Mass
913.68
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Lipids and lipid-like molecules
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Class
Fatty Acyls
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Subclass
Fatty acyl thioesters
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Level 5
Acyl CoAs
- Level 6 3-oxo-acyl CoAs
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Level 5
Acyl CoAs
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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
Direct Parent
3-oxo-acyl CoAs
Alternative Parents
Coenzyme A and derivatives Purine ribonucleoside diphosphates Pentose phosphates Ribonucleoside 3'-phosphates Alkyl-phenylketones Beta amino acids and derivatives Glycosylamines 6-aminopurines Monosaccharide phosphates Organic pyrophosphates Aryl alkyl ketones Benzoyl derivatives Aminopyrimidines and derivatives Monoalkyl phosphates N-acyl amines Imidolactams 1,3-dicarbonyl compounds N-substituted imidazoles Heteroaromatic compounds Tetrahydrofurans Secondary carboxylic acid amides Secondary alcohols Carbothioic S-esters Thioesters Azacyclic compounds Oxacyclic compounds Sulfenyl compounds Hydrocarbon derivatives Organic oxides Organopnictogen compounds Primary amines
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 phosphate - Pentose-5-phosphate - Alkyl-phenylketone - Beta amino acid or derivatives - Glycosyl compound - N-glycosyl compound - 6-aminopurine - Pentose monosaccharide - Monosaccharide phosphate - Organic pyrophosphate - Purine - Phenylketone - Imidazopyrimidine - Benzoyl - Aryl alkyl ketone - Aryl ketone - Aminopyrimidine - Monoalkyl phosphate - Monocyclic benzene moiety - Fatty amide - Monosaccharide - N-acyl-amine - N-substituted imidazole - Organic phosphoric acid derivative - Imidolactam - Benzenoid - Alkyl phosphate - Phosphoric acid ester - 1,3-dicarbonyl compound - Pyrimidine - Tetrahydrofuran - Heteroaromatic compound - Imidazole - Azole - Carbothioic s-ester - Secondary carboxylic acid amide - Secondary alcohol - Carboxamide group - Thiocarboxylic acid ester - Ketone - Amino acid or derivatives - Azacycle - Sulfenyl compound - Oxacycle - Organoheterocyclic compound - Thiocarboxylic acid or derivatives - Carboxylic acid derivative - Organonitrogen compound - Hydrocarbon derivative - Organic nitrogen compound - Organopnictogen compound - Organic oxide - Primary amine - Carbonyl group - Alcohol - Organosulfur compound - Amine - Organooxygen compound - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 3-oxo-acyl coas. These are organic compounds containing a 3-oxo acylated coenzyme A derivative.
External Descriptors
CHEBI:27388 : acyl-CoA