Compound Identification
SMILES
CC(C)(C)OC(=O)[N+]12CCCC1C(=O)CC2
InChIKey
InChIKey=OENDHYOUCBHJCN-UHFFFAOYSA-N
Formula
C12H20NO3
Mass
226.295
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Pyrrolizidines
- Subclass Pyrrolizidinones
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Class
Pyrrolizidines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrrolizidines
Subclass
Pyrrolizidinones
Intermediate Tree Nodes
Not available
Direct Parent
Pyrrolizidinones
Alternative Parents
Pyrrolidine carboxylic acids Pyrrolidine-3-ones N-alkylpyrrolidines Quaternary ammonium salts Ketones Azacyclic compounds Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Pyrrolizidinone - Pyrrolidine carboxylic acid - Pyrrolidine carboxylic acid or derivatives - Pyrrolidone - N-alkylpyrrolidine - 3-pyrrolidone - Pyrrolidine - Quaternary ammonium salt - Ketone - Azacycle - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organic cation - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as pyrrolizidinones. These are compounds containing a pyrrolizidine moiety which bears a ketone. Pyrrolizidine is a bicyclic ring system made up of two fused pyrrolidine ring sharing a nitrogen atom.
External Descriptors
Not available