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)n1cnc2c(N)ncnc12)C(O)C(=O)NCCC(=O)NCCSC(=O)\C=C\CC\C=C/C\C=C/C=C/C=C/[C@H](SC[C@H](N)C(O)=O)[C@H](O)CCCC(O)=O
InChIKey
InChIKey=KBFUWUDFICVJDA-XHAWYCJXSA-N
Formula
C44H67N8O22P3S2
Mass
1217.1
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
Enoyl CoAs
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Level 6
Long-chain enoyl CoAs
- Level 7 Long-chain 2-enoyl CoAs
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Level 6
Long-chain enoyl CoAs
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Level 5
Enoyl CoAs
-
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
Enoyl CoAs - Long-chain enoyl CoAs
Direct Parent
Long-chain 2-enoyl CoAs
Alternative Parents
2-enoyl CoAs Acyl CoAs Coenzyme A and derivatives Purine ribonucleoside diphosphates Hydroxyeicosapentaenoic acids Pentose phosphates Ribonucleoside 3'-phosphates Long-chain fatty acids L-cysteine-S-conjugates Beta amino acids and derivatives Glycosylamines 6-aminopurines Organic pyrophosphates L-alpha-amino acids Monosaccharide phosphates Aminopyrimidines and derivatives Thia fatty acids Hydroxy fatty acids Monoalkyl phosphates Unsaturated fatty acids N-acyl amines Imidolactams N-substituted imidazoles Dicarboxylic acids and derivatives Heteroaromatic compounds Oxolanes Secondary carboxylic acid amides Thioesters Amino acids Secondary alcohols Carbothioic S-esters Sulfenyl compounds Azacyclic compounds Oxacyclic compounds Dialkylthioethers Carboxylic acids Organic oxides Monoalkylamines Carbonyl compounds Hydrocarbon derivatives Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Coenzyme a or derivatives - Purine ribonucleoside 3',5'-bisphosphate - Purine ribonucleoside bisphosphate - Purine ribonucleoside diphosphate - Hydroxyeicosapentaenoic acid - Eicosanoid - Ribonucleoside 3'-phosphate - Pentose phosphate - Pentose-5-phosphate - Long-chain fatty acid - L-cysteine-s-conjugate - Cysteine or derivatives - Beta amino acid or derivatives - Glycosyl compound - N-glycosyl compound - Monosaccharide phosphate - Organic pyrophosphate - Alpha-amino acid - Pentose monosaccharide - 6-aminopurine - L-alpha-amino acid - Alpha-amino acid or derivatives - Imidazopyrimidine - Purine - Monoalkyl phosphate - Hydroxy fatty acid - Aminopyrimidine - Thia fatty acid - Imidolactam - Fatty acid - Alkyl phosphate - N-substituted imidazole - Unsaturated fatty acid - Organic phosphoric acid derivative - Fatty amide - Dicarboxylic acid or derivatives - Phosphoric acid ester - Monosaccharide - N-acyl-amine - Pyrimidine - Oxolane - Imidazole - Heteroaromatic compound - Azole - Amino acid - Carboxamide group - Secondary carboxylic acid amide - Thiocarboxylic acid ester - Carbothioic s-ester - Secondary alcohol - Amino acid or derivatives - Azacycle - Dialkylthioether - Organoheterocyclic compound - Sulfenyl compound - Thioether - Thiocarboxylic acid or derivatives - Oxacycle - Carboxylic acid derivative - Carboxylic acid - Amine - Hydrocarbon derivative - Carbonyl group - Primary amine - Organic nitrogen compound - Organosulfur compound - Organic oxygen compound - Organooxygen compound - Alcohol - Organonitrogen compound - Primary aliphatic amine - Organopnictogen compound - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as long-chain 2-enoyl coas. These are organic compounds containing a coenzyme A substructure linked to a long-chain 2-enoyl chain of 13 to 21 carbon atoms.
External Descriptors
Not available