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=C(O)C=C1
InChIKey
InChIKey=OVQOJJJXNYHOPR-FUEUKBNZSA-N
Formula
C30H42N7O19P3S
Mass
929.68
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
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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
Acyl CoAs
Direct Parent
3-oxo-acyl 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 1-hydroxy-2-unsubstituted benzenoids Aminopyrimidines and derivatives Monoalkyl phosphates Imidolactams 1,3-dicarbonyl compounds N-acyl amines N-substituted imidazoles Heteroaromatic compounds Oxolanes Thioesters Carbothioic S-esters Secondary alcohols Secondary carboxylic acid amides Oxacyclic compounds Azacyclic compounds Sulfenyl compounds Hydrocarbon derivatives 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 - Glycosyl compound - N-glycosyl compound - 6-aminopurine - Pentose monosaccharide - Monosaccharide phosphate - Organic pyrophosphate - Purine - Imidazopyrimidine - Phenylketone - Aryl ketone - Aryl alkyl ketone - Benzoyl - Aminopyrimidine - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Monoalkyl phosphate - Monosaccharide - N-acyl-amine - N-substituted imidazole - Organic phosphoric acid derivative - Fatty amide - Monocyclic benzene moiety - Imidolactam - Benzenoid - Phosphoric acid ester - Alkyl phosphate - 1,3-dicarbonyl compound - Pyrimidine - Imidazole - Heteroaromatic compound - Azole - Oxolane - Carbothioic s-ester - Ketone - Secondary alcohol - Carboxamide group - Secondary carboxylic acid amide - Amino acid or derivatives - Thiocarboxylic acid ester - Sulfenyl compound - Thiocarboxylic acid or derivatives - Carboxylic acid derivative - Organoheterocyclic compound - Azacycle - Oxacycle - Organonitrogen compound - Carbonyl group - Organic oxygen compound - Alcohol - Organooxygen compound - Organosulfur compound - Primary amine - Organic oxide - Amine - Hydrocarbon derivative - Organic nitrogen 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
Not available