Compound Identification
SMILES
O[C@@]1(CO[C@@H]2[C@H](CO[C@H]12)OO\C([O-])=N\C1=C[N+](=NO1)N1CCOCC1)[N+]([O-])=O
InChIKey
InChIKey=DMGRRHUYMZSFAD-UIMWLRQOSA-N
Formula
C13H17N5O10
Mass
403.304
Taxonomic Classification
Taxonomy Tree
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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
Morpholines 1,2,3-oxadiazoles Oxolanes Heteroaromatic compounds C-nitro compounds Propargyl-type 1,3-dipolar organic compounds Alkanolamines Azacyclic compounds Oxacyclic compounds Organic oxoazanium compounds Dialkyl ethers Carboximidic acids and derivatives Hydrocarbon derivatives Organic salts Organic oxides Organic zwitterions
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Isosorbide - Morpholine - Oxazinane - Azole - Oxadiazole - Oxolane - 1,2,3-oxadiazole - Heteroaromatic compound - Organic nitro compound - C-nitro compound - Dialkyl ether - Oxacycle - Azacycle - Ether - Organic 1,3-dipolar compound - Organic oxoazanium - Alkanolamine - Carboximidic acid derivative - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organonitrogen compound - Organooxygen compound - Organic oxide - Organic nitrogen compound - Organic oxygen compound - Organic zwitterion - Organic salt - Hydrocarbon derivative - 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