Compound Identification
SMILES
CC1=CC=C(C=C1)C(=O)C[C@H](C(O)=O)C1=CNC2=CC=CC=C12
InChIKey
InChIKey=YUHMKRQBVXAVHK-HNNXBMFYSA-N
Formula
C19H17NO3
Mass
307.349
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Indoles and derivatives
-
Subclass
Indolyl carboxylic acids and derivatives
- Level 5 Indole-3-acetic acid derivatives
-
Subclass
Indolyl carboxylic acids and derivatives
-
Class
Indoles and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Indoles and derivatives
Subclass
Indolyl carboxylic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Indole-3-acetic acid derivatives
Alternative Parents
Alkyl-phenylketones Butyrophenones 3-alkylindoles Aryl alkyl ketones Benzoyl derivatives Gamma-keto acids and derivatives Toluenes Substituted pyrroles Heteroaromatic compounds Carboxylic acids Monocarboxylic acids and derivatives Azacyclic compounds Hydrocarbon derivatives Organic oxides Organonitrogen compounds Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alkyl-phenylketone - Indole-3-acetic acid derivative - Butyrophenone - 3-alkylindole - Phenylketone - Indole - Benzoyl - Gamma-keto acid - Aryl alkyl ketone - Aryl ketone - Toluene - Monocyclic benzene moiety - Keto acid - Benzenoid - Substituted pyrrole - Heteroaromatic compound - Pyrrole - Ketone - Monocarboxylic acid or derivatives - Azacycle - Carboxylic acid - Carboxylic acid derivative - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Carbonyl group - Organopnictogen compound - Organic oxygen compound - Organooxygen compound - Organic nitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as indole-3-acetic acid derivatives. These are compounds containing an acetic acid (or a derivative) linked to the C3 carbon atom of an indole.
External Descriptors
Not available