Compound Identification
SMILES
OCC1=CC(=O)C(O)=C(C[NH+]2CCCCC2)O1
InChIKey
InChIKey=VRGCYEBOWZEYAK-UHFFFAOYSA-O
Formula
C12H18NO4
Mass
240.278
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Pyrans
- Subclass Pyranones and derivatives
-
Class
Pyrans
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrans
Subclass
Pyranones and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Pyranones and derivatives
Alternative Parents
Aralkylamines Piperidines Quaternary ammonium salts Heteroaromatic compounds Trialkylamines Cyclic ketones Oxacyclic compounds Azacyclic compounds Primary alcohols Organic oxides Hydrocarbon derivatives Aromatic alcohols Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Pyranone - Aralkylamine - Piperidine - Quaternary ammonium salt - Heteroaromatic compound - Tertiary amine - Tertiary aliphatic amine - Cyclic ketone - Oxacycle - Azacycle - Aromatic alcohol - Alcohol - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Primary alcohol - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Amine - Organic cation - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as pyranones and derivatives. These are compounds containing a pyran ring which bears a ketone.
External Descriptors
Not available