Compound Identification
SMILES
[Cl-].CCCCCCCCCCCCCCCCCCCCCC[N+]1=C(\C=C/C=C2/N(CCCCCCCCCCCCCC)C3=C(C=C(CNC(=O)CCCC(=O)N\N=C\CCCC(=O)N[C@H]4CCC5=CC(OC)=C(OC)C(OC)=C5C5=CC=C(SC)C(=O)C=C45)C=C3)C2(C)C)C(C)(C)C2=CC=CC=C12
InChIKey
InChIKey=MRDNGTDXUPSLSJ-MCKNPSIISA-N
Formula
C90H135ClN6O7S
Mass
1480.62
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
Tropones Tertiary alkylarylamines Anisoles Alkyl aryl ethers Alkylarylthioethers N-acyl amines Secondary carboxylic acid amides Amino acids and derivatives Cyclic ketones Sulfenyl compounds Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Enamines Organic zwitterions Organic chloride salts Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
3-alkylindole - Aryl thioether - Tropone - Anisole - Tertiary aliphatic/aromatic amine - Phenol ether - Alkyl aryl ether - Alkylarylthioether - Benzenoid - Fatty amide - N-acyl-amine - Fatty acyl - Amino acid or derivatives - Carboxamide group - Secondary carboxylic acid amide - Cyclic ketone - Tertiary amine - Carboxylic acid derivative - Enamine - Ether - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Thioether - Sulfenyl compound - Organonitrogen compound - Organic chloride salt - Organic oxide - Organic oxygen compound - Amine - Organooxygen compound - Organosulfur compound - Organic salt - Carbonyl group - Organic zwitterion - Hydrocarbon derivative - Organic nitrogen compound - 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