Compound Identification
SMILES
OC(=O)CC(O)(CC(O)=O)C(O)=O.CC1=CSC2=NC(C)=C(CCN3CCC(CC3)C3=CNC4=CC=CC=C34)C(=O)N12
InChIKey
InChIKey=JLPCTCIREFJHNN-UHFFFAOYSA-N
Formula
C29H34N4O8S
Mass
598.67
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
Tricarboxylic acids and derivatives Pyrimidones Aralkylamines Alpha hydroxy acids and derivatives Substituted pyrroles Piperidines Benzenoids Thiazoles Tertiary alcohols Heteroaromatic compounds Trialkylamines Lactams Azacyclic compounds Carboxylic acids Carbonyl compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Not available
Substituents
3-alkylindole - Tricarboxylic acid or derivatives - Pyrimidone - Aralkylamine - Alpha-hydroxy acid - Hydroxy acid - Piperidine - Pyrimidine - Substituted pyrrole - Benzenoid - Azole - Heteroaromatic compound - Pyrrole - Tertiary alcohol - Thiazole - Lactam - Tertiary amine - Tertiary aliphatic amine - Carboxylic acid - Carboxylic acid derivative - Azacycle - Amine - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Carbonyl group - Alcohol - 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