Compound Identification
SMILES
COC1=CC(=CC(OC)=C1OC)C(C[N+]([O-])=O)[C@@]1(O)C(=O)O[C@@H]2[C@@H](O)CO[C@]12O
InChIKey
InChIKey=ZPYHHTKZFDHPND-LAGYBHIKSA-N
Formula
C17H21NO11
Mass
415.351
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
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Class
Furofurans
- Subclass Isosorbides
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Class
Furofurans
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Furofurans
Subclass
Isosorbides
Intermediate Tree Nodes
Not available
Direct Parent
Isosorbides
Alternative Parents
Anisoles Phenoxy compounds Methoxybenzenes Alkyl aryl ethers Gamma butyrolactones Monosaccharides Tertiary alcohols Oxolanes Secondary alcohols C-nitro compounds Carboxylic acid esters Hemiacetals Propargyl-type 1,3-dipolar organic compounds Polyols Oxacyclic compounds Organic oxoazanium compounds Monocarboxylic acids and derivatives Organic zwitterions Organic salts Hydrocarbon derivatives Carbonyl compounds Organonitrogen compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Isosorbide - Phenoxy compound - Anisole - Methoxybenzene - Phenol ether - Alkyl aryl ether - Monocyclic benzene moiety - Gamma butyrolactone - Monosaccharide - Benzenoid - Oxolane - Tertiary alcohol - Carboxylic acid ester - Hemiacetal - Lactone - Secondary alcohol - Organic nitro compound - C-nitro compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Organic 1,3-dipolar compound - Ether - Oxacycle - Monocarboxylic acid or derivatives - Polyol - Organic oxoazanium - Organic zwitterion - Hydrocarbon derivative - Carbonyl group - Organic nitrogen compound - Organic oxygen compound - Organic salt - Organic oxide - 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