Compound Identification
SMILES
COC1OC2COC(OC2C(NC#N)C1OS(C)(=O)=O)C1=CC=CC=C1
InChIKey
InChIKey=IREUYWGAJDIEAS-UHFFFAOYSA-N
Formula
C16H20N2O7S
Mass
384.4
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Pyranodioxins
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyranodioxins
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Pyranodioxins
Alternative Parents
Sulfonic acid esters Oxanes Organosulfonic acid esters Monosaccharides Benzene and substituted derivatives 1,3-dioxanes Sulfonyls Methanesulfonates Oxacyclic compounds Dialkylamines Acetals Organopnictogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyranodioxin - Benzenoid - Organosulfonic acid ester - Sulfonic acid ester - Oxane - Monosaccharide - Monocyclic benzene moiety - Meta-dioxane - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Methanesulfonate - Oxacycle - Secondary amine - Secondary aliphatic amine - Acetal - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Amine - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as pyranodioxins. These are polycyclic compounds containing a pyranodioxin moiety, which consists of a pyran ring fused to a dioxin ring.
External Descriptors
Not available