Compound Identification
SMILES
O[C@H]1CO[C@@]2(O)[C@@H]1OC(=O)[C@]2(O)C(C[N+]([O-])=O)C1=CC=CC=C1
InChIKey
InChIKey=LTVWNKVTTMPOBB-RZZUOMTDSA-N
Formula
C14H15NO8
Mass
325.273
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Furofurans
- Subclass Isosorbides
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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
Benzene and substituted derivatives Gamma butyrolactones Monosaccharides Tertiary alcohols Oxolanes Secondary alcohols C-nitro compounds Carboxylic acid esters Hemiacetals Organic oxoazanium compounds Polyols Monocarboxylic acids and derivatives Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds Organic salts Organic zwitterions Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Isosorbide - Monocyclic benzene moiety - Gamma butyrolactone - Monosaccharide - Benzenoid - Oxolane - Tertiary alcohol - Organic nitro compound - Carboxylic acid ester - Hemiacetal - Lactone - C-nitro compound - Secondary alcohol - Organic 1,3-dipolar compound - Polyol - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Oxacycle - Organic oxoazanium - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Organic salt - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organic nitrogen compound - Organic oxygen compound - Organic zwitterion - Organonitrogen compound - Organooxygen compound - Alcohol - Aromatic 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