Compound Identification
SMILES
CC1(C)C(\C=C\C=C\C=C2/N(CCCCCC(O)=O)C3=C(C=C(C=C3)S(O)(=O)=O)C2(C)C)=NC2=[N+](CCCS(O)(=O)=O)C=C(Br)C=C12
InChIKey
InChIKey=JCGXOOHQPBBXBR-UHFFFAOYSA-O
Formula
C33H41BrN3O8S2
Mass
751.73
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Pyrrolopyridines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrrolopyridines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Pyrrolopyridines
Alternative Parents
1-sulfo,2-unsubstituted aromatic compounds Indoles and derivatives Tertiary alkylarylamines Medium-chain fatty acids Amino fatty acids Halogenated fatty acids Heterocyclic fatty acids Pyridinium derivatives Aryl bromides Benzenoids Heteroaromatic compounds Organosulfonic acids Alkanesulfonic acids Sulfonyls Amino acids Ketimines Enamines Carboxylic acids Azacyclic compounds Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives Organobromides Carbonyl compounds Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Arylsulfonic acid or derivatives - Indole or derivatives - Pyrrolopyridine - 1-sulfo,2-unsubstituted aromatic compound - Tertiary aliphatic/aromatic amine - Medium-chain fatty acid - Amino fatty acid - Halogenated fatty acid - Heterocyclic fatty acid - Aryl bromide - Aryl halide - Pyridine - Pyridinium - Fatty acyl - Benzenoid - Sulfonyl - Organosulfonic acid - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Heteroaromatic compound - Alkanesulfonic acid - Amino acid or derivatives - Tertiary amine - Ketimine - Amino acid - Azacycle - Carboxylic acid derivative - Carboxylic acid - Enamine - Monocarboxylic acid or derivatives - Organic nitrogen compound - Amine - Imine - Hydrocarbon derivative - Organic oxide - Organohalogen compound - Organobromide - Organonitrogen compound - Carbonyl group - Organic oxygen compound - Organooxygen compound - Organosulfur compound - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as pyrrolopyridines. These are compounds containing a pyrrolopyridine moiety, which consists of a pyrrole ring fused to a pyridine. Pyrrole is 5-membered ring consisting of four carbon atoms and one nitrogen atom. Pyridine is a 6-membered ring consisting of five carbon atoms and one nitrogen center.
External Descriptors
Not available