Compound Identification
SMILES
[H]C(O)(C(O)=NCCC(O)=NCCSC(=O)CC(=O)CCCCCCCCCCC(O)=O)C(C)(C)COP(O)(=O)OP(O)(=O)OCC1([H])OC([H])(N2C=NC3=C(N)N=CN=C23)C([H])(O)C1([H])OP(O)(O)=O
InChIKey
InChIKey=BBFDWYFIECYVAX-UHFFFAOYSA-N
Formula
C35H58N7O20P3S
Mass
1021.86
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
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Level 6
3-oxo-acyl CoAs
- Level 7 Long-chain 3-oxoacyl CoAs
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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 - 3-oxo-acyl CoAs
Direct Parent
Long-chain 3-oxoacyl CoAs
Alternative Parents
Long-chain fatty acyl CoAs 2,3,4-saturated fatty acyl CoAs Coenzyme A and derivatives Purine ribonucleoside diphosphates Ribonucleoside 3'-phosphates Pentose phosphates Long-chain fatty acids Glycosylamines 6-aminopurines Monosaccharide phosphates Organic pyrophosphates Keto fatty acids Aminopyrimidines and derivatives Thia fatty acids Monoalkyl phosphates Hydroxy fatty acids Imidolactams 1,3-dicarbonyl compounds N-substituted imidazoles Heteroaromatic compounds Oxolanes Thioesters Secondary alcohols Amino acids Carbothioic S-esters Ketones Carboxylic acids Carboximidic acids Sulfenyl compounds Azacyclic compounds Oxacyclic compounds Monocarboxylic acids and derivatives Propargyl-type 1,3-dipolar organic compounds Primary amines Organic oxides Hydrocarbon derivatives
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 - Long-chain fatty acid - Glycosyl compound - N-glycosyl compound - 6-aminopurine - Monosaccharide phosphate - Organic pyrophosphate - Pentose monosaccharide - Imidazopyrimidine - Purine - Aminopyrimidine - Hydroxy fatty acid - Keto fatty acid - Monoalkyl phosphate - Thia fatty acid - Alkyl phosphate - N-substituted imidazole - Pyrimidine - Organic phosphoric acid derivative - 1,3-dicarbonyl compound - Monosaccharide - Phosphoric acid ester - Imidolactam - Fatty acid - Heteroaromatic compound - Azole - Imidazole - Oxolane - Amino acid - Ketone - Carbothioic s-ester - Thiocarboxylic acid ester - Amino acid or derivatives - Secondary alcohol - Propargyl-type 1,3-dipolar organic compound - Sulfenyl compound - Organic 1,3-dipolar compound - Thiocarboxylic acid or derivatives - Carboximidic acid - Carboximidic acid derivative - Carboxylic acid derivative - Carboxylic acid - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Oxacycle - Azacycle - Organic oxygen compound - Organic oxide - Organic nitrogen compound - Alcohol - Organosulfur compound - Hydrocarbon derivative - Amine - Organooxygen compound - Organonitrogen compound - Primary amine - Carbonyl group - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as long-chain 3-oxoacyl coas. These are organic compounds containing a coenzyme A derivative, which is 3-oxo acylated long aliphatic chain of 13 to 21 carbon atoms.
External Descriptors
Not available