Compound Identification
SMILES
[H]\C(=C(\CC(O)=O)C(=O)SCCN=C(O)CCN=C(O)C(O)C(C)(C)COP(O)(=O)OP(O)(=O)OCC1OC(C(O)C1OP(O)(O)=O)N1C=NC2=C(N)N=CN=C12)C1=CC=CC(C)=C1
InChIKey
InChIKey=NUYXAUMLJJDWJX-UDWIEESQSA-N
Formula
C33H46N7O19P3S
Mass
969.74
Taxonomic Classification
Taxonomy Tree
-
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
- 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
Not available
Direct Parent
Acyl CoAs
Alternative Parents
Coenzyme A and derivatives Purine ribonucleoside diphosphates Pentose phosphates Ribonucleoside 3'-phosphates Cinnamic acids and derivatives Glycosylamines 6-aminopurines Monosaccharide phosphates Organic pyrophosphates Toluenes Aminopyrimidines and derivatives Thia fatty acids Monoalkyl phosphates Hydroxy fatty acids N-substituted imidazoles Imidolactams Tetrahydrofurans Heteroaromatic compounds Secondary alcohols Carbothioic S-esters Thioesters Amino acids Sulfenyl compounds Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Oxacyclic compounds Carboximidic acids Monocarboxylic acids and derivatives Carboxylic acids Primary amines Organopnictogen compounds Organic oxides Carbonyl compounds Hydrocarbon derivatives
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 - Cinnamic acid or derivatives - Glycosyl compound - N-glycosyl compound - Organic pyrophosphate - Pentose monosaccharide - 6-aminopurine - Monosaccharide phosphate - Purine - Imidazopyrimidine - Hydroxy fatty acid - Toluene - Thia fatty acid - Aminopyrimidine - Monoalkyl phosphate - Monocyclic benzene moiety - Monosaccharide - N-substituted imidazole - Organic phosphoric acid derivative - Imidolactam - Phosphoric acid ester - Benzenoid - Alkyl phosphate - Pyrimidine - Tetrahydrofuran - Azole - Heteroaromatic compound - Imidazole - Thiocarboxylic acid ester - Secondary alcohol - Carbothioic s-ester - Amino acid - Amino acid or derivatives - Thiocarboxylic acid or derivatives - Organic 1,3-dipolar compound - Sulfenyl compound - Propargyl-type 1,3-dipolar organic compound - Carboximidic acid - Carboximidic acid derivative - Carboxylic acid derivative - Carboxylic acid - Oxacycle - Monocarboxylic acid or derivatives - Azacycle - Organoheterocyclic compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Organosulfur compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Primary amine - Carbonyl group - Alcohol - Amine - Organic nitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as acyl coas. These are organic compounds containing a coenzyme A substructure linked to an acyl chain.
External Descriptors
Not available