Compound Identification
SMILES
CCOC(=O)CNC(=O)C1=CC=C(OP(=O)(OC2=CC=C(C=C2)C(=O)NCC(=O)OCC)C2CCCN2C(=O)[C@@H]2CCCN2)C=C1
InChIKey
InChIKey=JFLWTONGCRBODS-PMCHYTPCSA-N
Formula
C31H39N4O10P
Mass
658.645
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Benzoic acids and derivatives
-
Level 5
Benzamides
- Level 6 Hippuric acids and derivatives
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Level 5
Benzamides
-
Subclass
Benzoic acids and derivatives
-
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
Alpha amino acid esters N-acyl-alpha amino acids and derivatives Alpha amino acid amides Benzoyl derivatives Pyrrolidinecarboxamides N-acylpyrrolidines Phenoxy compounds Phosphonic acid diesters Dicarboxylic acids and derivatives Phosphonic acid esters Tertiary carboxylic acid amides Secondary carboxylic acid amides Carboxylic acid esters Azacyclic compounds Dialkylamines Organic oxides Hydrocarbon derivatives Carbonyl compounds Organophosphorus compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alpha-amino acid ester - Hippuric acid or derivatives - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Alpha-amino acid or derivatives - Phenoxy compound - Benzoyl - N-acylpyrrolidine - Pyrrolidine-2-carboxamide - Pyrrolidine carboxylic acid or derivatives - Phosphonic acid diester - Dicarboxylic acid or derivatives - Phosphonic acid ester - Tertiary carboxylic acid amide - Pyrrolidine - Organophosphonic acid derivative - Amino acid or derivatives - Carboxamide group - Carboxylic acid ester - Secondary carboxylic acid amide - Organoheterocyclic compound - Azacycle - Secondary aliphatic amine - Carboxylic acid derivative - Secondary amine - Amine - Organic oxide - Organic oxygen compound - Carbonyl group - Hydrocarbon derivative - Organic nitrogen compound - Organophosphorus compound - Organonitrogen compound - Organooxygen compound - Aromatic heteromonocyclic 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