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@@H](O)C(=O)NCCC(=O)NCCSC(=O)CCCCCCCCCCCOC1=C(C=C(C=C1)N=[N+]=[N-])[N+]([O-])=O
InChIKey
InChIKey=YTTUVWRNKSNZFE-LFZQUHGESA-N
Formula
C39H60N11O20P3S
Mass
1127.95
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
Acyl CoAs
- Level 6 2,3,4-saturated fatty acyl CoAs
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Level 5
Acyl 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
Acyl CoAs
Direct Parent
2,3,4-saturated fatty acyl CoAs
Alternative Parents
Medium-chain fatty acyl CoAs Coenzyme A and derivatives Purine ribonucleoside diphosphates Pentose phosphates Ribonucleoside 3'-phosphates Beta amino acids and derivatives Glycosylamines Nitrophenyl ethers 6-aminopurines Organic pyrophosphates Monosaccharide phosphates Phenylazides Phenoxy compounds Phenol ethers Nitroaromatic compounds Alkyl aryl ethers Monoalkyl phosphates Aminopyrimidines and derivatives Imidolactams N-substituted imidazoles N-acyl amines Oxolanes Heteroaromatic compounds Secondary alcohols Azo compounds Azo imides Secondary carboxylic acid amides Carbothioic S-esters Thioesters Oxacyclic compounds Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Sulfenyl compounds Organic oxoazanium compounds Primary amines Carbonyl compounds Organic zwitterions Hydrocarbon derivatives Organic salts Organic oxides
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 - Beta amino acid or derivatives - Nitrophenyl ether - Glycosyl compound - N-glycosyl compound - 6-aminopurine - Monosaccharide phosphate - Organic pyrophosphate - Pentose monosaccharide - Imidazopyrimidine - Nitrobenzene - Purine - Phenoxy compound - Nitroaromatic compound - Phenol ether - Phenylazide - Monoalkyl phosphate - Aminopyrimidine - Alkyl aryl ether - Alkyl phosphate - Benzenoid - Monocyclic benzene moiety - Pyrimidine - Fatty amide - Organic phosphoric acid derivative - Monosaccharide - Imidolactam - N-acyl-amine - Phosphoric acid ester - N-substituted imidazole - Heteroaromatic compound - Imidazole - Azole - Oxolane - Thiocarboxylic acid ester - Amino acid or derivatives - Azo compound - Azo imide - Secondary carboxylic acid amide - Secondary alcohol - Carboxamide group - Organic nitro compound - Carbothioic s-ester - C-nitro compound - Organic oxoazanium - Organic 1,3-dipolar compound - Sulfenyl compound - Allyl-type 1,3-dipolar organic compound - Thiocarboxylic acid or derivatives - Carboxylic acid derivative - Ether - Propargyl-type 1,3-dipolar organic compound - Organoheterocyclic compound - Azacycle - Oxacycle - Carbonyl group - Organic nitrogen compound - Amine - Organic zwitterion - Organic oxide - Organosulfur compound - Organooxygen compound - Organic oxygen compound - Organonitrogen compound - Organic salt - Alcohol - Hydrocarbon derivative - Primary amine - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 2,3,4-saturated fatty acyl coas. These are acyl-CoAs carrying a 2,3,4-saturated fatty acyl chain.
External Descriptors
Not available