Compound Identification
SMILES
CC(C)C(O)(C(C)O)C(=O)OCC1CC[N+]2(CCCCCCCCC[N+]34CCCC3C(COC(=O)C(O)(C(C)C)C(C)O)CC4)CCCC12
InChIKey
InChIKey=KLDXJGYHISVOPE-UHFFFAOYSA-N
Formula
C39H72N2O8
Mass
697.01
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Pyrrolizidines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrrolizidines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Pyrrolizidines
Alternative Parents
Fatty acid esters Beta hydroxy acids and derivatives N-alkylpyrrolidines Dicarboxylic acids and derivatives Tetraalkylammonium salts Tertiary alcohols Secondary alcohols Carboxylic acid esters Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds Amines Organic cations
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Pyrrolizidine - Beta-hydroxy acid - Fatty acid ester - Dicarboxylic acid or derivatives - Hydroxy acid - N-alkylpyrrolidine - Fatty acyl - Tetraalkylammonium salt - Tertiary alcohol - Quaternary ammonium salt - Pyrrolidine - Secondary alcohol - Carboxylic acid ester - Azacycle - Carboxylic acid derivative - Hydrocarbon derivative - Amine - Organonitrogen compound - Organic oxygen compound - Alcohol - Organooxygen compound - Organic oxide - Carbonyl group - Organic nitrogen compound - Organic cation - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as pyrrolizidines. These are compounds containing a pyrrolizidine, which is a bicyclic ring system made up of two fused pyrrolidine ring sharing a nitrogen atom.
External Descriptors
Not available