Compound Identification
SMILES
CC(C)(C)C(=O)C=CNC1=CC(O)=C(C=C1)C(O)=O
InChIKey
InChIKey=XHSADBSHXPPSDO-UHFFFAOYSA-N
Formula
C14H17NO4
Mass
263.293
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Benzoic acids and derivatives
-
Level 5
Hydroxybenzoic acid derivatives
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Level 6
Salicylic acid and derivatives
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Level 7
Aminosalicylic acids and derivatives
- Level 8 Aminosalicylic acids
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Level 7
Aminosalicylic acids and derivatives
-
Level 6
Salicylic acid and derivatives
-
Level 5
Hydroxybenzoic acid derivatives
-
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
Hydroxybenzoic acid derivatives - Salicylic acid and derivatives - Aminosalicylic acids and derivatives
Direct Parent
Aminosalicylic acids
Alternative Parents
4-aminosalicylic acids Salicylic acids Aminobenzoic acids Benzoic acids m-Aminophenols Benzoyl derivatives Aniline and substituted anilines 1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids Vinylogous amides Vinylogous acids Enones Acryloyl compounds Ketones Enamines Carboxylic acids Allylamines Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
4-aminosalicylic acid - Aminosalicylic acid - Aminobenzoic acid - Aminobenzoic acid or derivatives - Salicylic acid - Benzoic acid - M-aminophenol - Benzoyl - Aniline or substituted anilines - Aminophenol - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Acryloyl-group - Enone - Vinylogous amide - Vinylogous acid - Alpha,beta-unsaturated ketone - Ketone - Allylamine - Carboxylic acid derivative - Carboxylic acid - Enamine - Organic nitrogen compound - Carbonyl group - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Amine - Organic oxygen compound - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as aminosalicylic acids. These are salicylic acids carrying an amino group on the benzene ring.
External Descriptors
Not available