Compound Identification
SMILES
COc1cc(C=CC(=O)SCCNC(=O)CCNC(=O)[C@H](O)C(C)(C)COP(O)(=O)OP(O)(=O)OC[C@H]2O[C@H]([C@H](O)[C@@H]2OP(O)(O)=O)n2cnc3c(N)ncnc23)cc(O)c1O
InChIKey
InChIKey=ILSPFIPSQSFPCN-PVMJKYSESA-N
Formula
C31H44N7O20P3S
Mass
959.7
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 2-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
Direct Parent
2-enoyl CoAs
Alternative Parents
Acyl CoAs Coenzyme A and derivatives Purine ribonucleoside diphosphates Pentose phosphates Ribonucleoside 3'-phosphates Hydroxycinnamic acids and derivatives Beta amino acids and derivatives Glycosylamines 6-aminopurines Methoxyphenols Monosaccharide phosphates Organic pyrophosphates Phenoxy compounds Anisoles Catechols Styrenes Methoxybenzenes 1-hydroxy-2-unsubstituted benzenoids Monoalkyl phosphates 1-hydroxy-4-unsubstituted benzenoids Alkyl aryl ethers Aminopyrimidines and derivatives Imidolactams N-substituted imidazoles N-acyl amines Heteroaromatic compounds Tetrahydrofurans Thioesters Secondary carboxylic acid amides Carbothioic S-esters Secondary alcohols Azacyclic compounds Oxacyclic compounds Sulfenyl compounds Primary amines Hydrocarbon derivatives Carbonyl compounds Organic oxides Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Coenzyme a or derivatives - Purine ribonucleoside diphosphate - Purine ribonucleoside bisphosphate - Purine ribonucleoside 3',5'-bisphosphate - Pentose-5-phosphate - Ribonucleoside 3'-phosphate - Pentose phosphate - Cinnamic acid or derivatives - Hydroxycinnamic acid or derivatives - Beta amino acid or derivatives - Glycosyl compound - N-glycosyl compound - 6-aminopurine - Pentose monosaccharide - Organic pyrophosphate - Monosaccharide phosphate - Methoxyphenol - Imidazopyrimidine - Purine - Catechol - Styrene - Phenol ether - Phenoxy compound - Anisole - Methoxybenzene - Alkyl aryl ether - Aminopyrimidine - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Monoalkyl phosphate - Phenol - Pyrimidine - Phosphoric acid ester - Alkyl phosphate - Monocyclic benzene moiety - Benzenoid - Fatty amide - Imidolactam - Organic phosphoric acid derivative - N-substituted imidazole - N-acyl-amine - Monosaccharide - Tetrahydrofuran - Azole - Heteroaromatic compound - Imidazole - Secondary alcohol - Secondary carboxylic acid amide - Thiocarboxylic acid ester - Amino acid or derivatives - Carboxamide group - Carbothioic s-ester - Organoheterocyclic compound - Azacycle - Ether - Oxacycle - Sulfenyl compound - Thiocarboxylic acid or derivatives - Carboxylic acid derivative - Primary amine - Organic oxygen compound - Carbonyl group - Amine - Alcohol - Organopnictogen compound - Organic nitrogen compound - Organooxygen compound - Organic oxide - Organonitrogen compound - Organosulfur compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 2-enoyl coas. These are organic compounds containing a coenzyme A substructure linked to a 2-enoyl chain.
External Descriptors
CHEBI:31136 : acyl-CoA