Compound Identification
SMILES
COC(=O)C1=C(SSC2=C(C(=O)OC)C3=C(OC(=O)C4=CC=CC=C34)N2C2=CC=C(C)C=C2)N(C2=C1C1=CC=CC=C1C(=O)O2)C1=CC=C(C)C=C1
InChIKey
InChIKey=AFGFBTAOBHADOO-UHFFFAOYSA-N
Formula
C40H28N2O8S2
Mass
728.79
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Pyrroles
-
Subclass
Substituted pyrroles
- Level 5 Phenylpyrroles
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Subclass
Substituted pyrroles
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Class
Pyrroles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrroles
Subclass
Substituted pyrroles
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpyrroles
Alternative Parents
Isocoumarins and derivatives 2-benzopyrans Pyrrole carboxylic acids and derivatives Toluenes Pyranones and derivatives Methyl esters Vinylogous amides Heteroaromatic compounds Organic disulfides Lactones Oxacyclic compounds Azacyclic compounds Sulfenyl compounds Organooxygen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Isocoumarin - 1-phenylpyrrole - Benzopyran - 2-benzopyran - Pyrrole-3-carboxylic acid or derivatives - Pyranone - Toluene - Monocyclic benzene moiety - Pyran - Benzenoid - Heteroaromatic compound - Vinylogous amide - Methyl ester - Carboxylic acid ester - Lactone - Organic disulfide - Carboxylic acid derivative - Oxacycle - Azacycle - Sulfenyl compound - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phenylpyrroles. These are polycyclic aromatic compounds containing a benzene ring linked to a pyrrole ring through a CC or CN bond.
External Descriptors
Not available