Compound Identification
SMILES
COC(=O)[C@@H]1[C@H](O)C(=O)N2CCC[C@H]12
InChIKey
InChIKey=FZPAKMGORUZZAQ-VQVTYTSYSA-N
Formula
C9H13NO4
Mass
199.206
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Pyrrolizidines
- Subclass Pyrrolizidinones
-
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 Beta hydroxy acids and derivatives Pyrrolidine-2-ones N-alkylpyrrolidines Tertiary carboxylic acid amides Methyl esters Secondary alcohols Lactams Monocarboxylic acids and derivatives Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Pyrrolizidinone - Pyrrolidine carboxylic acid - Pyrrolidine carboxylic acid or derivatives - Beta-hydroxy acid - Hydroxy acid - Pyrrolidone - N-alkylpyrrolidine - 2-pyrrolidone - Pyrrolidine - Methyl ester - Tertiary carboxylic acid amide - Lactam - Carboxylic acid ester - Carboxamide group - Secondary alcohol - Azacycle - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Alcohol - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - 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