Compound Identification
SMILES
COC1=CC(\C=C\C(=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)N2C=NC3=C2N=CN=C3N)=CC(O)=C1O
InChIKey
InChIKey=ILSPFIPSQSFPCN-VYBUCKLUSA-J
Formula
C31H40N7O20P3S
Mass
955.67
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Fatty Acyls
-
Subclass
Fatty acyl thioesters
-
Level 5
Enoyl CoAs
- Level 6 2-enoyl CoAs
-
Level 5
Enoyl CoAs
-
Subclass
Fatty acyl thioesters
-
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 Ribonucleoside 3'-phosphates Pentose phosphates Hydroxycinnamic acids and derivatives Beta amino acids and derivatives Glycosylamines 6-aminopurines Methoxyphenols Monosaccharide phosphates Organic pyrophosphates Anisoles Styrenes Catechols Methoxybenzenes Phenoxy compounds Alkyl aryl ethers Aminopyrimidines and derivatives 1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids N-substituted imidazoles Imidolactams N-acyl amines Alkyl phosphates Oxolanes Heteroaromatic compounds Secondary alcohols Secondary carboxylic acid amides Thioesters Carbothioic S-esters Oxacyclic compounds Azacyclic compounds Sulfenyl compounds Organic oxides Hydrocarbon derivatives Primary amines Carbonyl compounds Organic anions
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-5-phosphate - Pentose phosphate - Hydroxycinnamic acid or derivatives - Cinnamic acid or derivatives - N-glycosyl compound - Glycosyl compound - Beta amino acid or derivatives - Methoxyphenol - Monosaccharide phosphate - 6-aminopurine - Organic pyrophosphate - Purine - Imidazopyrimidine - Phenoxy compound - Phenol ether - Styrene - Anisole - Catechol - Methoxybenzene - Aminopyrimidine - 1-hydroxy-2-unsubstituted benzenoid - Alkyl aryl ether - Phenol - 1-hydroxy-4-unsubstituted benzenoid - Monocyclic benzene moiety - Fatty amide - Imidolactam - Benzenoid - Alkyl phosphate - Monosaccharide - N-acyl-amine - N-substituted imidazole - Organic phosphoric acid derivative - Pyrimidine - Phosphoric acid ester - Azole - Heteroaromatic compound - Oxolane - Imidazole - Secondary alcohol - Secondary carboxylic acid amide - Amino acid or derivatives - Thiocarboxylic acid ester - Carboxamide group - Carbothioic s-ester - Thiocarboxylic acid or derivatives - Sulfenyl compound - Carboxylic acid derivative - Oxacycle - Azacycle - Organoheterocyclic compound - Ether - Amine - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Primary amine - Alcohol - Organic oxygen compound - Organic anion - 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
Not available