Compound Identification
SMILES
CN1C2CCC1C(\C=C\C1=[N+](CCCSOOO)C3=C(C=C(SOOO)C=C3)C1(C)C)=C(SCCC(O)=O)/C/2=C/C=C1/N(CCCSOOO)C2=C(C=C(C=C2)S(O)(=O)=O)C1(C)C
InChIKey
InChIKey=XFBISQRSJYADOQ-UHFFFAOYSA-O
Formula
C41H52N3O14S5
Mass
971.17
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
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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 Benzenoids N-alkylpyrrolidines Sulfonyls Organosulfonic acids Trialkylamines Thioenol ethers Amino acids Sulfenyl compounds Azacyclic compounds Carboxylic acids Enamines Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives Carbonyl compounds Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
3-alkylindole - Arylsulfonic acid or derivatives - 1-sulfo,2-unsubstituted aromatic compound - Benzenoid - N-alkylpyrrolidine - Pyrrolidine - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Sulfonyl - Amino acid or derivatives - Amino acid - Tertiary aliphatic amine - Thioenolether - Tertiary amine - Carboxylic acid derivative - Carboxylic acid - Enamine - Monocarboxylic acid or derivatives - Azacycle - Sulfenyl compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Organosulfur compound - Organic oxide - Hydrocarbon derivative - Carbonyl group - Amine - 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