Compound Identification
SMILES
COCCN1CCN(CC1)C1=NC(=CS1)C1=CC=C(C=C1)C(=O)N[C@@H](C1CCCCC1)C(=O)N1C[C@H](N)[C@@H]2OCC(=O)[C@@H]12
InChIKey
InChIKey=SVKJEBSHVULNKB-HXVUFMGFSA-N
Formula
C31H42N6O5S
Mass
610.77
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 N-arylpiperazines Benzoyl derivatives N-acylpyrrolidines Dialkylarylamines Furopyrroles 2,4-disubstituted thiazoles N-alkylpiperazines 2-amino-1,3-thiazoles Furanones Tertiary carboxylic acid amides Oxolanes Heteroaromatic compounds Trialkylamines Secondary carboxylic acid amides Ketones Dialkyl ethers Azacyclic compounds Oxacyclic compounds Organic oxides Monoalkylamines Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Hippuric acid or derivatives - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - N-arylpiperazine - Alpha-amino acid or derivatives - N-acylpyrrolidine - Benzoyl - Dialkylarylamine - Furopyrrole - 2,4-disubstituted 1,3-thiazole - N-alkylpiperazine - 1,3-thiazol-2-amine - 3-furanone - Piperazine - 1,4-diazinane - Heteroaromatic compound - Azole - Oxolane - Thiazole - Tertiary carboxylic acid amide - Pyrrolidine - Ketone - Amino acid or derivatives - Carboxamide group - Tertiary aliphatic amine - Secondary carboxylic acid amide - Tertiary amine - Oxacycle - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Dialkyl ether - Ether - Amine - Organic oxide - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Primary amine - Organooxygen compound - Organonitrogen compound - Primary aliphatic amine - 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