Compound Identification
SMILES
CC(C)(C1=N[C@H]2[C@@H](O1)O[C@@H]1CO[C@H](O[C@H]1[C@@H]2OC(=O)C1=CC=CC=C1)C1=CC=CC=C1)C1=N[C@H]2[C@@H](O1)O[C@@H]1CO[C@H](O[C@H]1[C@@H]2OC(=O)C1=CC=CC=C1)C1=CC=CC=C1
InChIKey
InChIKey=CQFZTRQCSIRUGB-GEPGMDKNSA-N
Formula
C45H42N2O12
Mass
802.833
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
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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
Benzoyl derivatives 1,3-dioxanes Oxanes Dicarboxylic acids and derivatives Monosaccharides Oxazolines Carboxylic acid esters Imidoesters Acetals Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Azacyclic compounds Hydrocarbon derivatives Organopnictogen compounds Organonitrogen compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzoate ester - Benzoyl - Meta-dioxane - Dicarboxylic acid or derivatives - Monosaccharide - Oxane - Oxazoline - Carboxylic acid ester - Imido ester - Propargyl-type 1,3-dipolar organic compound - Azacycle - Oxacycle - Acetal - Carboxylic acid derivative - Organic 1,3-dipolar compound - Organoheterocyclic compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Organopnictogen compound - Organic oxygen compound - 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