Compound Identification
SMILES
CC1(C)\C(=C\C=C2\CCCC(\C=C\C3=[N+](CCCCS(O)(=O)=O)C4=C(C=C(C=C4)S(O)(=O)=O)C3(C)C)=C2OC2=CC=C(CCC(=O)NCCC(O)(P([O-])([O-])=O)P([O-])([O-])=O)C=C2)N(CCCCS(O)(=O)=O)C2=C1C=C(C=C2)S(O)(=O)=O
InChIKey
InChIKey=UKFGXUHXIGTCQD-UHFFFAOYSA-K
Formula
C50H62N3O21P2S4
Mass
1231.24
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
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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 Bisphosphonates Tertiary alkylarylamines Phenoxy compounds Fatty amides Sulfonyls Organosulfonic acids Alkanesulfonic acids Organic phosphonic acids Secondary carboxylic acid amides Amino acids and derivatives Azacyclic compounds Enamines Organophosphorus compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organic salts Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
3-alkylindole - Arylsulfonic acid or derivatives - Bisphosphonate - 1-sulfo,2-unsubstituted aromatic compound - Tertiary aliphatic/aromatic amine - Phenoxy compound - Monocyclic benzene moiety - Fatty acyl - Fatty amide - Benzenoid - Organophosphonic acid derivative - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Organophosphonic acid - Alkanesulfonic acid - Sulfonyl - Tertiary amine - Carboxamide group - Secondary carboxylic acid amide - Amino acid or derivatives - Azacycle - Carboxylic acid derivative - Enamine - Organosulfur compound - Organic salt - Organic nitrogen compound - Amine - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organophosphorus 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