Compound Identification
SMILES
CCCCC1=NC=C(\C=C(/CC2=CC=CS2)C(=O)OC2=CC=CC=C2CO[N+]([O-])=O)N1CC1=CC=C(C=C1)C(=O)OC1=CC=CC=C1CO[N+]([O-])=O
InChIKey
InChIKey=XCFIKKMSLHHLLK-TWKHWXDSSA-N
Formula
C37H34N4O10S
Mass
726.76
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
- Class Depsides and depsidones
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Depsides and depsidones
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Depsides and depsidones
Alternative Parents
Phenol esters Benzoic acid esters Phenoxy compounds 1,2,5-trisubstituted imidazoles Imidazolyl carboxylic acids and derivatives Benzoyl derivatives Fatty acid esters N-substituted imidazoles Thiophenes Alkyl nitrates Heteroaromatic compounds Enoate esters Organic nitro compounds Organic nitric acids and derivatives Azacyclic compounds Monocarboxylic acids and derivatives Organonitrogen compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organic salts Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Depside backbone - Benzoate ester - Phenol ester - Benzoic acid or derivatives - Phenoxy compound - Imidazolyl carboxylic acid derivative - Trisubstituted imidazole - 1,2,5-trisubstituted-imidazole - Benzoyl - Fatty acid ester - N-substituted imidazole - Monocyclic benzene moiety - Fatty acyl - Benzenoid - Organic nitrate - Azole - Heteroaromatic compound - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Alkyl nitrate - Thiophene - Imidazole - Organic nitro compound - Organic nitric acid or derivatives - Carboxylic acid ester - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Carboxylic acid derivative - Allyl-type 1,3-dipolar organic compound - Monocarboxylic acid or derivatives - Organic oxygen compound - Organic oxide - Carbonyl group - Hydrocarbon derivative - Organic nitrogen compound - Organooxygen compound - Organic salt - Organonitrogen compound - Organic cation - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as depsides and depsidones. These are polycyclic compounds that is either a polyphenolic compound composed of two or more monocyclic aromatic units linked by an ester bond (depside), or a compound containing the depsidone structure (depsidone).
External Descriptors
Not available