Compound Identification
SMILES
CC(CCN1C=C(C=C2C1=N\C(=C/C=C/C1=NC3=C(C=C(C=[N+]3CCCCCC(O)=O)C#N)C1(C)C)C2(C)C)C#N)S(O)(=O)=O
InChIKey
InChIKey=SRPXTOUMWJUIFI-UHFFFAOYSA-O
Formula
C33H39N6O5S
Mass
631.77
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
Medium-chain fatty acids Thia fatty acids Dihydropyridines Heterocyclic fatty acids Pyridinium derivatives Imidolactams Sulfonyls Pyrrolines Organosulfonic acids Alkanesulfonic acids Heteroaromatic compounds Ketimines Azacyclic compounds Carboxamidines Carboximidamides Carboxylic acids Monocarboxylic acids and derivatives Nitriles Enamines Carbonyl compounds Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyrrolopyridine - Medium-chain fatty acid - Heterocyclic fatty acid - Thia fatty acid - Dihydropyridine - Pyridine - Pyridinium - Imidolactam - Fatty acyl - Heteroaromatic compound - Alkanesulfonic acid - Pyrroline - Organic sulfonic acid or derivatives - Sulfonyl - Organosulfonic acid - Organosulfonic acid or derivatives - Ketimine - Carboxylic acid derivative - Carboxylic acid amidine - Carboxylic acid - Nitrile - Carbonitrile - Amidine - Monocarboxylic acid or derivatives - Carboximidamide - Azacycle - Enamine - Organic nitrogen compound - Amine - Organonitrogen compound - Organooxygen compound - Imine - Organosulfur compound - Hydrocarbon derivative - Organic oxide - Cyanide - Organic oxygen compound - Carbonyl group - 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