Compound Identification
SMILES
C\C=C\CC(=O)SCCNC(=O)CCNC(=O)[C@H](O)C(C)(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.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@@H](O)C(=O)NCCC(=O)NCCSC(=O)CCCO
InChIKey
InChIKey=LGSITBCGNIPMKB-ONWAAPAJSA-N
Formula
C51H84N14O35P6S2
Mass
1703.26
Taxonomic Classification
Taxonomy Tree
-
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 3-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
-
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
3-enoyl CoAs
Alternative Parents
Acyl CoAs Coenzyme A and derivatives Purine ribonucleoside diphosphates Ribonucleoside 3'-phosphates Pentose phosphates Beta amino acids and derivatives Glycosylamines 6-aminopurines Monosaccharide phosphates Organic pyrophosphates Aminopyrimidines and derivatives Monoalkyl phosphates Imidolactams N-acyl amines N-substituted imidazoles Oxolanes Heteroaromatic compounds Thioesters Carbothioic S-esters Secondary alcohols Secondary carboxylic acid amides Oxacyclic compounds Azacyclic compounds Sulfenyl compounds Hydrocarbon derivatives Primary alcohols Primary amines Carbonyl compounds Organic oxides
Molecular Framework
Not available
Substituents
Coenzyme a or derivatives - Purine ribonucleoside 3',5'-bisphosphate - Purine ribonucleoside bisphosphate - Purine ribonucleoside diphosphate - Pentose phosphate - Ribonucleoside 3'-phosphate - Pentose-5-phosphate - Beta amino acid or derivatives - Glycosyl compound - N-glycosyl compound - 6-aminopurine - Monosaccharide phosphate - Organic pyrophosphate - Imidazopyrimidine - Purine - Monoalkyl phosphate - Aminopyrimidine - Imidolactam - Alkyl phosphate - Fatty amide - Pyrimidine - Monosaccharide - N-acyl-amine - N-substituted imidazole - Organic phosphoric acid derivative - Phosphoric acid ester - Azole - Imidazole - Heteroaromatic compound - Oxolane - Amino acid or derivatives - Thiocarboxylic acid ester - Carboxamide group - Secondary carboxylic acid amide - Secondary alcohol - Carbothioic s-ester - Sulfenyl compound - Azacycle - Carboxylic acid derivative - Thiocarboxylic acid or derivatives - Organoheterocyclic compound - Oxacycle - Organosulfur compound - Organic nitrogen compound - Organooxygen compound - Primary alcohol - Carbonyl group - Organonitrogen compound - Organic oxygen compound - Alcohol - Amine - Organic oxide - Primary amine - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 3-enoyl coas. These are organic compounds containing a coenzyme A substructure linked to a 3-enoyl chain.
External Descriptors
Not available