Compound Identification
SMILES
OCCNC(=O)C1=CC(CNC(=O)C2=CC3OC4(CC5=CC=CC=C5C4)OC3C(C2)OC(=O)C2=CC=CC(C=COCCO)=C2)=CC=C1
InChIKey
InChIKey=VQSPBCCAVMSWOF-UHFFFAOYSA-N
Formula
C37H38N2O9
Mass
654.716
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Benzenoids
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Class
Benzene and substituted derivatives
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Subclass
Benzoic acids and derivatives
- Level 5 Benzoic acid esters
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Subclass
Benzoic acids and derivatives
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzoic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Benzoic acid esters
Alternative Parents
Benzamides Indanes Styrenes Benzoyl derivatives N-acylethanolamines Ketals 1,3-dioxolanes Secondary carboxylic acid amides Carboxylic acid esters Oxacyclic compounds Monocarboxylic acids and derivatives Organic oxides Carbonyl compounds Organopnictogen compounds Hydrocarbon derivatives Primary alcohols
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzoate ester - Benzamide - Indane - Benzoyl - N-acylethanolamine - Styrene - Ketal - Meta-dioxolane - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid ester - Oxacycle - Organoheterocyclic compound - Alkanolamine - Acetal - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Alcohol - Organopnictogen compound - Organonitrogen compound - Carbonyl group - Organooxygen compound - Organic oxygen compound - Organic nitrogen compound - Primary alcohol - Hydrocarbon derivative - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzoic acid esters. These are ester derivatives of benzoic acid.
External Descriptors
Not available