Compound Identification
SMILES
COC1=CC=C(NCCNC(=O)[C@H](CC2CCCCC2)NC(=O)C2=CC(C)=C(OCC3=CC=CC=C3)C(C)=C2)C=C1
InChIKey
InChIKey=KRKMEKXKBPXSFP-HKBQPEDESA-N
Formula
C34H43N3O4
Mass
557.735
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
N-acyl-alpha amino acids and derivatives Alpha amino acid amides Aminophenyl ethers Methoxyanilines m-Xylenes Anisoles Benzoyl derivatives Methoxybenzenes Phenylalkylamines Phenoxy compounds Secondary alkylarylamines Alkyl aryl ethers Fatty amides Secondary carboxylic acid amides Hydrocarbon derivatives Organic oxides Organopnictogen compounds Carbonyl compounds
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Hippuric acid or derivatives - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - N-substituted-alpha-amino acid - Alpha-amino acid or derivatives - Aminophenyl ether - Methoxyaniline - Phenoxy compound - Benzoyl - Anisole - Phenol ether - Aniline or substituted anilines - Phenylalkylamine - M-xylene - Methoxybenzene - Xylene - Secondary aliphatic/aromatic amine - Alkyl aryl ether - Fatty acyl - Fatty amide - Secondary carboxylic acid amide - Carboxamide group - Amino acid or derivatives - Secondary amine - Carboxylic acid derivative - Ether - Organic nitrogen compound - Carbonyl group - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Amine - Organic oxide - Organopnictogen compound - Organic oxygen compound - Aromatic homomonocyclic 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