Compound Identification
SMILES
CC(C)C1=CC(C(C)C)=C(O)C(=C1)C(=O)OCC(=O)C1=C(C)N(C(C)=C1)C1=CC(C)=C(C)C=C1
InChIKey
InChIKey=MRDMOFHAJLFHSI-UHFFFAOYSA-N
Formula
C29H35NO4
Mass
461.602
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Pyrroles
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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
o-Hydroxybenzoic acid esters Salicylic acid and derivatives Phenylpropanes Cumenes o-Xylenes Aryl alkyl ketones Benzoyl derivatives Phenols Vinylogous amides Vinylogous acids Heteroaromatic compounds Carboxylic acid esters Azacyclic compounds Organonitrogen compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
O-hydroxybenzoic acid ester - 1-phenylpyrrole - Benzoate ester - Salicylic acid or derivatives - Benzoic acid or derivatives - Cumene - Phenylpropane - O-xylene - Xylene - Benzoyl - Aryl ketone - Aryl alkyl ketone - Phenol - Benzenoid - Monocyclic benzene moiety - Heteroaromatic compound - Vinylogous amide - Vinylogous acid - Ketone - Carboxylic acid ester - Carboxylic acid derivative - Azacycle - Organic oxide - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Aromatic heteromonocyclic 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