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(O)C(=O)NCCC(=O)NCCSC(=O)C\C=C\CC\C=C/C=C/C=C/[C@@H](SC[C@@H](N)C(O)=O)[C@@H](O)CCCC(O)=O
InChIKey
InChIKey=ANLFIWCXIHNIAL-CAIMCJOESA-N
Formula
C42H65N8O22P3S2
Mass
1191.06
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 3-enoyl CoAs
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Level 6
Long-chain enoyl CoAs
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Level 5
Enoyl CoAs
-
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
Enoyl CoAs - Long-chain enoyl CoAs
Direct Parent
Long-chain 3-enoyl CoAs
Alternative Parents
3-enoyl CoAs Acyl CoAs Coenzyme A and derivatives Purine ribonucleoside diphosphates Pentose phosphates Ribonucleoside 3'-phosphates Lineolic acids and derivatives Long-chain fatty acids Cysteine and derivatives S-alkyl-L-cysteines Glycosylamines Beta amino acids and derivatives 6-aminopurines D-alpha-amino acids Monosaccharide phosphates Organic pyrophosphates Monoalkyl phosphates Thia fatty acids Hydroxy fatty acids Aminopyrimidines and derivatives N-acyl amines Dicarboxylic acids and derivatives Unsaturated fatty acids Imidolactams N-substituted imidazoles Oxolanes Heteroaromatic compounds Secondary alcohols Secondary carboxylic acid amides Thioesters Amino acids Carbothioic S-esters Carboxylic acids Oxacyclic compounds Azacyclic compounds Sulfenyl compounds Dialkylthioethers Carbonyl compounds Organopnictogen compounds Organic oxides Monoalkylamines 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 - Octadecanoid - Long-chain fatty acid - Cysteine or derivatives - Beta amino acid or derivatives - Glycosyl compound - N-glycosyl compound - S-alkyl-l-cysteine - 6-aminopurine - Alpha-amino acid - Alpha-amino acid or derivatives - Monosaccharide phosphate - Organic pyrophosphate - Pentose monosaccharide - D-alpha-amino acid - Imidazopyrimidine - Purine - Aminopyrimidine - Monoalkyl phosphate - Hydroxy fatty acid - Thia fatty acid - Fatty acid - Imidolactam - Dicarboxylic acid or derivatives - Fatty amide - Alkyl phosphate - Unsaturated fatty acid - Monosaccharide - N-acyl-amine - N-substituted imidazole - Organic phosphoric acid derivative - Phosphoric acid ester - Pyrimidine - Heteroaromatic compound - Oxolane - Imidazole - Azole - Secondary alcohol - Carboxamide group - Secondary carboxylic acid amide - Thiocarboxylic acid ester - Amino acid - Amino acid or derivatives - Carbothioic s-ester - Thioether - Sulfenyl compound - Azacycle - Thiocarboxylic acid or derivatives - Dialkylthioether - Carboxylic acid derivative - Organoheterocyclic compound - Oxacycle - Carboxylic acid - Primary amine - Organic nitrogen compound - Alcohol - Organooxygen compound - Organic oxide - Amine - Organosulfur compound - Carbonyl group - Organopnictogen compound - Primary aliphatic amine - Hydrocarbon derivative - Organonitrogen compound - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as long-chain 3-enoyl coas. These are organic compounds containing a coenzyme A substructure linked to a long-chain 3-enoyl chain of 13 to 21 carbon atoms.
External Descriptors
Not available