Compound Identification
SMILES
CC1(C)C2=C(C=CC(=C2)S(O)(=O)=O)N2CCCCCC(=O)NC3=CC(NC(=O)CCCCC[N+]4=C(\C=C\C=C1\2)C(C)(C)C1=C4C=CC(SOOO)=C1)=CC(=C3)C(O)=O
InChIKey
InChIKey=KJTMNUCKMSKYOA-UHFFFAOYSA-O
Formula
C42H49N4O10S2
Mass
833.99
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Indoles and derivatives
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Subclass
Indoles
- Level 5 3-alkylindoles
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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
3-alkylindoles
Alternative Parents
1-sulfo,2-unsubstituted aromatic compounds Benzenoids Sulfonyls Organosulfonic acids Tertiary amines Amino acids Lactams Secondary carboxylic acid amides Enamines Carboxylic acids Azacyclic compounds Sulfenyl compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
3-alkylindole - Arylsulfonic acid or derivatives - 1-sulfo,2-unsubstituted aromatic compound - Benzenoid - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl - Organosulfonic acid - Amino acid or derivatives - Carboxamide group - Amino acid - Lactam - Secondary carboxylic acid amide - Tertiary amine - Carboxylic acid derivative - Carboxylic acid - Enamine - Azacycle - Sulfenyl compound - Organonitrogen compound - Hydrocarbon derivative - Organic nitrogen compound - Amine - Organic oxide - Organooxygen compound - Organosulfur compound - Organic oxygen compound - Carbonyl group - Organic cation - 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