Compound Identification
SMILES
NC=C1C(=O)CCOC1=O
InChIKey
InChIKey=JCVFDMOXFXJTSJ-UHFFFAOYSA-N
Formula
C6H7NO3
Mass
141.126
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Lactones
- Subclass Delta valerolactones
-
Class
Lactones
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Lactones
Subclass
Delta valerolactones
Intermediate Tree Nodes
Not available
Direct Parent
Delta valerolactones
Alternative Parents
Oxanes Vinylogous amides Enoate esters Cyclic ketones Amino acids and derivatives Oxacyclic compounds Monocarboxylic acids and derivatives Enamines Allylamines Organic oxides Monoalkylamines Hydrocarbon derivatives
Molecular Framework
Aliphatic heteromonocyclic compounds
Substituents
Delta valerolactone - Delta_valerolactone - Oxane - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Vinylogous amide - Amino acid or derivatives - Cyclic ketone - Carboxylic acid ester - Ketone - Allylamine - Oxacycle - Carboxylic acid derivative - Enamine - Monocarboxylic acid or derivatives - Amine - Primary aliphatic amine - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Organic oxide - Primary amine - Carbonyl group - Hydrocarbon derivative - Aliphatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as delta valerolactones. These are cyclic organic compounds containing an oxan-2- one moiety.
External Descriptors
Not available