Compound Identification
SMILES
O[C@@H]1CO[C@@H]2[C@H](CO[C@H]12)O[N+]([O-])=O
InChIKey
InChIKey=YWXYYJSYQOXTPL-JGWLITMVSA-N
Formula
C6H9NO6
Mass
191.139
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Furofurans
- Subclass Isosorbides
-
Class
Furofurans
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Furofurans
Subclass
Isosorbides
Intermediate Tree Nodes
Not available
Direct Parent
Isosorbides
Alternative Parents
Tetrahydrofurans Alkyl nitrates Secondary alcohols Organic nitro compounds Organic nitric acids and derivatives Oxacyclic compounds Dialkyl ethers Organic zwitterions Organic oxides Organic nitrogen compounds Hydrocarbon derivatives
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Isosorbide - Organic nitrate - Tetrahydrofuran - Alkyl nitrate - Organic nitric acid or derivatives - Secondary alcohol - Organic nitro compound - Dialkyl ether - Ether - Oxacycle - Allyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organooxygen compound - Organic oxide - Organic oxygen compound - Hydrocarbon derivative - Alcohol - Organic zwitterion - Organic nitrogen compound - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as isosorbides. These are organic polycyclic compounds containing an isosorbide(1,4-Dianhydrosorbitol) moiety, which consists of two -oxolan-3-ol rings.
External Descriptors
Not available