Compound Identification
SMILES
CC(CC(O)(CC1=CNC2=CC=CC=C12)C(O)=O)C(O)=O
InChIKey
InChIKey=NITKWNUMEQFAHX-UHFFFAOYSA-N
Formula
C15H17NO5
Mass
291.303
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Indoles and derivatives
-
Subclass
Indoles
- Level 5 3-alkylindoles
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Subclass
Indoles
-
Class
Indoles and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Indoles and derivatives
Subclass
Indoles
Intermediate Tree Nodes
Not available
Direct Parent
3-alkylindoles
Alternative Parents
Medium-chain hydroxy acids and derivatives Medium-chain fatty acids Amino fatty acids Methyl-branched fatty acids Hydroxy fatty acids Heterocyclic fatty acids Substituted pyrroles Alpha hydroxy acids and derivatives Dicarboxylic acids and derivatives Benzenoids Tertiary alcohols Heteroaromatic compounds Azacyclic compounds Carboxylic acids Carbonyl compounds Hydrocarbon derivatives Organic oxides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
3-alkylindole - Medium-chain hydroxy acid - Medium-chain fatty acid - Amino fatty acid - Branched fatty acid - Heterocyclic fatty acid - Methyl-branched fatty acid - Hydroxy fatty acid - Alpha-hydroxy acid - Dicarboxylic acid or derivatives - Hydroxy acid - Fatty acyl - Fatty acid - Benzenoid - Substituted pyrrole - Heteroaromatic compound - Tertiary alcohol - Pyrrole - Azacycle - Carboxylic acid - Carboxylic acid derivative - Organic nitrogen compound - Alcohol - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 3-alkylindoles. These are compounds containing an indole moiety that carries an alkyl chain at the 3-position.
External Descriptors
Not available