Compound Identification
SMILES
COC(=O)C1=C(NC(=O)C(SC2=CC=CC(NC(=O)C(\NC(=O)C3=CC=CC=C3)=C/C3=CC=C(OC)C=C3)=C2)C2=CC=CC=C2)SC2=C1CCN(C2)C(=O)OC(C)(C)C
InChIKey
InChIKey=UIVYTGMKPJHXTL-KVQDIILNSA-N
Formula
C45H44N4O8S2
Mass
832.99
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
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Level 5
Benzamides
- Level 6 Hippuric acids and derivatives
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Level 5
Benzamides
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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
Benzamides
Direct Parent
Hippuric acids and derivatives
Alternative Parents
N-acyl-alpha amino acids and derivatives Alpha amino acid amides Cinnamic acid amides Phenylacetamides Anilides Thienopyridines Thiophenol ethers Anisoles Benzoyl derivatives Thiophene carboxylic acids and derivatives Methoxybenzenes N-arylamides Phenoxy compounds Alkyl aryl ethers Alkylarylthioethers Heteroaromatic compounds Carbamate esters Methyl esters Vinylogous amides Secondary carboxylic acid amides Sulfenyl compounds Azacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-acyl-alpha amino acid or derivatives - Hippuric acid or derivatives - Cinnamic acid or derivatives - Alpha-amino acid amide - Cinnamic acid amide - Phenylacetamide - Alpha-amino acid or derivatives - Thienopyridine - Anilide - Methoxybenzene - Aryl thioether - Phenoxy compound - Thiophene carboxylic acid or derivatives - N-arylamide - Phenol ether - Thiophenol ether - Benzoyl - Anisole - Alkylarylthioether - Alkyl aryl ether - Heteroaromatic compound - Vinylogous amide - Methyl ester - Carbamic acid ester - Thiophene - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid ester - Thioether - Sulfenyl compound - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Ether - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Organonitrogen compound - Organosulfur compound - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as hippuric acids and derivatives. These are compounds containing a hippuric acid or a derivative, with a structure characterized the presence of a benzoyl group linked to the N-terminal of a glycine.
External Descriptors
Not available