Compound Identification
SMILES
COC(=O)C1=CC=C(C=C1)C(NC(=O)OCC1=CC=CC=C1)C(=C\[C@@H](C)C(O)=O)\C1=CN=CC=C1
InChIKey
InChIKey=MSFUVWQQQVMDOQ-GLNRAPIASA-N
Formula
C27H26N2O6
Mass
474.513
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
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
Benzyloxycarbonyls Benzoyl derivatives Medium-chain fatty acids Amino fatty acids Branched fatty acids Heterocyclic fatty acids Unsaturated fatty acids Pyridines and derivatives Heteroaromatic compounds Carbamate esters Methyl esters Carboxylic acids Azacyclic compounds Monocarboxylic acids and derivatives Organonitrogen compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Benzoate ester - Benzyloxycarbonyl - Benzoyl - Medium-chain fatty acid - Amino fatty acid - Branched fatty acid - Heterocyclic fatty acid - Pyridine - Unsaturated fatty acid - Fatty acyl - Fatty acid - Carbamic acid ester - Methyl ester - Heteroaromatic compound - Carboxylic acid ester - Organoheterocyclic compound - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Azacycle - Carboxylic acid - Organic oxide - Organonitrogen compound - Carbonyl group - Organooxygen compound - Hydrocarbon derivative - Organic oxygen compound - Organic nitrogen compound - Aromatic heteromonocyclic 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