Compound Identification
SMILES
CC[C@H](C)C[C@H](N(C)C)C1=NC(C(O)=O)=C(O1)C1=CNC2=CC=CC=C12
InChIKey
InChIKey=PBQNIVCBQWLBLF-LRDDRELGSA-N
Formula
C20H25N3O3
Mass
355.438
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Indoles and derivatives
- Subclass Indoles
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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
Indoles
Alternative Parents
2,4,5-trisubstituted oxazoles Aralkylamines Substituted pyrroles Benzenoids Heteroaromatic compounds Trialkylamines Amino acids Oxacyclic compounds Monocarboxylic acids and derivatives Carboxylic acids Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Indole - 2,4,5-trisubstituted 1,3-oxazole - Aralkylamine - Substituted pyrrole - Benzenoid - Azole - Oxazole - Heteroaromatic compound - Pyrrole - Amino acid or derivatives - Amino acid - Tertiary aliphatic amine - Tertiary amine - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Oxacycle - Azacycle - Organic oxygen compound - Organic oxide - Amine - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organopnictogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as indoles. These are compounds containing an indole moiety, which consists of pyrrole ring fused to benzene to form 2,3-benzopyrrole.
External Descriptors
CHEBI:66681 : tertiary amino compound - 1,3-oxazoles - monocarboxylic acid - indole alkaloid