Compound Identification
SMILES
C.[O-][N+]([O-])=O.[O-][N+]([O-])=O.[O-][N+]([O-])=O.OCC(O)CO
InChIKey
InChIKey=BWXGDWUQYZWZOR-UHFFFAOYSA-N
Formula
C4H12N3O12
Mass
294.151
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic oxygen compounds
-
Class
Organooxygen compounds
-
Subclass
Carbohydrates and carbohydrate conjugates
- Level 5 Sugar alcohols
-
Subclass
Carbohydrates and carbohydrate conjugates
-
Class
Organooxygen compounds
-
Superclass
Organic oxygen compounds
Kingdom
Organic compounds
Superclass
Organic oxygen compounds
Class
Organooxygen compounds
Subclass
Carbohydrates and carbohydrate conjugates
Intermediate Tree Nodes
Not available
Direct Parent
Sugar alcohols
Alternative Parents
Organic nitrates Secondary alcohols Organic nitro compounds Organic nitric acids 1,2-diols Primary alcohols Organic salts Organic oxides Organic nitrogen compounds Hydrocarbon derivatives Saturated hydrocarbons Organic cations
Molecular Framework
Not available
Substituents
Sugar alcohol - Organic nitrate - 1,2-diol - Organic nitric acid - Organic nitric acid or derivatives - Secondary alcohol - Organic nitro compound - Polyol - Primary alcohol - Alcohol - Organic salt - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Saturated hydrocarbon - Hydrocarbon - Organic cation - Aliphatic acyclic compound
Description
This compound belongs to the class of organic compounds known as sugar alcohols. These are hydrogenated forms of carbohydrate in which the carbonyl group (aldehyde or ketone, reducing sugar) has been reduced to a primary or secondary hydroxyl group.
External Descriptors
Not available