Compound Identification
SMILES
CC1=C(C)C2=C(C3=CC(C)=C(OS(=O)(=O)C4=C(C=C(OC(=O)C5=CC=C(C=C5)C#N)C=C4)C(O)=O)C(C)=C3)C3=CC=CC=C3C(Br)=C2S1
InChIKey
InChIKey=FIMJYJQQMHINRT-UHFFFAOYSA-N
Formula
C37H26BrNO7S2
Mass
740.64
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
Naphthothiophenes Benzenesulfonate esters Phenol esters Benzoic acid esters 1-benzothiophenes Arylsulfonic acids and derivatives Benzenesulfonyl compounds Benzoic acids m-Xylenes Phenoxy compounds Benzonitriles Benzoyl derivatives Aryl bromides Organosulfonic acid esters Thiophenes Sulfonyls Heteroaromatic compounds Carboxylic acid esters Nitriles Carboxylic acids Hydrocarbon derivatives Organic oxides Organobromides Organooxygen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Depside backbone - Naphthothiophene - Benzenesulfonate ester - Naphthalene - Phenol ester - Benzenesulfonate - Benzoate ester - Benzothiophene - Benzoic acid - Arylsulfonic acid or derivatives - 1-benzothiophene - Benzoic acid or derivatives - Benzenesulfonyl group - Phenoxy compound - Benzonitrile - Benzoyl - Xylene - M-xylene - Benzenoid - Monocyclic benzene moiety - Organosulfonic acid ester - Aryl halide - Aryl bromide - Thiophene - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Heteroaromatic compound - Carboxylic acid ester - Organoheterocyclic compound - Carboxylic acid derivative - Carboxylic acid - Nitrile - Carbonitrile - Organobromide - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Organic nitrogen compound - Organohalogen compound - Organic oxygen compound - Cyanide - Organic oxide - Aromatic heteropolycyclic 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