Structure Information
Structure

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)\C=C\C1=CC=C(O)C=C1

InChIKey

InChIKey=DMZOKBALNZWDKI-MATMFAIHSA-J

Formula

C30H38N7O18P3S

Mass

909.65

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Taxonomic Classification

Taxonomy Tree

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

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 - Coumaric acid or derivatives - Beta amino acid or derivatives - N-glycosyl compound - Glycosyl compound - Monosaccharide phosphate - Organic pyrophosphate - 6-aminopurine - Imidazopyrimidine - Purine - Styrene - Phenol - Aminopyrimidine - 1-hydroxy-2-unsubstituted benzenoid - Monocyclic benzene moiety - Fatty amide - Imidolactam - Monosaccharide - N-acyl-amine - N-substituted imidazole - Organic phosphoric acid derivative - Benzenoid - Alkyl phosphate - Phosphoric acid ester - Pyrimidine - Tetrahydrofuran - Azole - Imidazole - Heteroaromatic compound - Secondary alcohol - Carboxamide group - Secondary carboxylic acid amide - Thiocarboxylic acid ester - Amino acid or derivatives - Carbothioic s-ester - Thiocarboxylic acid or derivatives - Sulfenyl compound - Organoheterocyclic compound - Azacycle - Oxacycle - Carboxylic acid derivative - Organosulfur compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Alcohol - Organopnictogen compound - Amine - Carbonyl group - Primary amine - Organic oxygen compound - Organic nitrogen compound - Organonitrogen 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

CHEBI:85008 : acyl-CoA(4-)

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