Compound Identification
SMILES
[Na+].[Na+].CC1(C)C(=CC=C2CCCC(C=CC3=[N+](CCCCS(O)(=O)=O)C4=CC=CC=C4C3(C)C)=C2C2=CC=C(C=C2)C([O-])=O)N(CCCCS(O)(=O)=O)C2=C1C=C(C=C2)S([O-])(=O)=O
InChIKey
InChIKey=RPBKGWIIDCQNJX-UHFFFAOYSA-M
Formula
C45H51N2Na2O11S3
Mass
938.06
Taxonomic Classification
Taxonomy Tree
-
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 Benzoic acids Tertiary alkylarylamines Benzoyl derivatives Sulfonyls Organosulfonic acids Alkanesulfonic acids Amino acids Carboxylic acid salts Azacyclic compounds Enamines Carboxylic acids Organooxygen compounds Hydrocarbon derivatives Organic sodium salts Organic oxides Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
3-alkylindole - Arylsulfonic acid or derivatives - Benzoic acid or derivatives - Benzoic acid - 1-sulfo,2-unsubstituted aromatic compound - Benzoyl - Tertiary aliphatic/aromatic amine - Monocyclic benzene moiety - Benzenoid - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Sulfonyl - Alkanesulfonic acid - Tertiary amine - Amino acid - Amino acid or derivatives - Carboxylic acid salt - Azacycle - Organic alkali metal salt - Carboxylic acid derivative - Carboxylic acid - Enamine - Organic salt - Organic sodium salt - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Amine - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Organic oxygen compound - 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