Compound Identification
SMILES
CC(C)(COP(O)(=O)OP(O)(=O)OCC1OC(C)(C(O)C1OP(O)(O)=O)N1C=NC2=C1N=CN=C2N)C(O)C(=O)NCCC(=O)NCCSC(=O)\C=C\CC[C@H](N)C(O)=O
InChIKey
InChIKey=ONEMMXGQZFHUNC-XRKYVJQNSA-N
Formula
C29H47N8O19P3S
Mass
936.71
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
- Level 6 Medium-chain 2-enoyl CoAs
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Level 5
Enoyl CoAs
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Subclass
Fatty acyl thioesters
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Class
Fatty Acyls
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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
Direct Parent
Medium-chain 2-enoyl CoAs
Alternative Parents
2-enoyl CoAs Acyl CoAs Coenzyme A and derivatives Purine ribonucleoside diphosphates Ribonucleoside 3'-phosphates Pentose phosphates C-glycosyl compounds Beta amino acids and derivatives L-alpha-amino acids Monosaccharide phosphates Organic pyrophosphates 6-aminopurines Medium-chain fatty acids Hydroxy fatty acids Monoalkyl phosphates Aminopyrimidines and derivatives N-substituted imidazoles N-acyl amines Unsaturated fatty acids Imidolactams Oxolanes Heteroaromatic compounds Carbothioic S-esters Thioesters Secondary alcohols Amino acids Secondary carboxylic acid amides Sulfenyl compounds Carboxylic acids Oxacyclic compounds Azacyclic compounds Monocarboxylic acids and derivatives Hydrocarbon derivatives Organic oxides Carbonyl compounds Monoalkylamines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Coenzyme a or derivatives - Purine ribonucleoside 3',5'-bisphosphate - Purine ribonucleoside bisphosphate - Purine ribonucleoside diphosphate - Pentose phosphate - Pentose-5-phosphate - Ribonucleoside 3'-phosphate - Beta amino acid or derivatives - C-glycosyl compound - Glycosyl compound - Pentose monosaccharide - L-alpha-amino acid - 6-aminopurine - Monosaccharide phosphate - Organic pyrophosphate - Alpha-amino acid or derivatives - Alpha-amino acid - Purine - Imidazopyrimidine - Medium-chain fatty acid - Aminopyrimidine - Hydroxy fatty acid - Monoalkyl phosphate - Fatty amide - Fatty acid - Imidolactam - Monosaccharide - N-acyl-amine - N-substituted imidazole - Organic phosphoric acid derivative - Alkyl phosphate - Unsaturated fatty acid - Phosphoric acid ester - Pyrimidine - Heteroaromatic compound - Azole - Oxolane - Imidazole - Secondary alcohol - Secondary carboxylic acid amide - Carbothioic s-ester - Amino acid - Amino acid or derivatives - Carboxamide group - Thiocarboxylic acid ester - Organoheterocyclic compound - Sulfenyl compound - Monocarboxylic acid or derivatives - Azacycle - Thiocarboxylic acid or derivatives - Oxacycle - Carboxylic acid - Carboxylic acid derivative - Organosulfur compound - Organic nitrogen compound - Carbonyl group - Alcohol - Primary aliphatic amine - Organic oxygen compound - Hydrocarbon derivative - Primary amine - Organic oxide - Amine - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as medium-chain 2-enoyl coas. These are organic compounds containing a coenzyme A substructure linked to a medium-chain 2-enoyl chain of 5 to 12 carbon atoms.
External Descriptors
Not available