Compound Identification
SMILES
OC[C@@H]1[C@@H](OCC2=CC=CC=C2)[C@H](O)C[S+]1C[C@H]1O[C@@H](OC[C@@H]1OS([O-])(=O)=O)C1=CC=CC=C1
InChIKey
InChIKey=DBTYIQPEPUJSNO-GTMGAWAKSA-N
Formula
C23H28O9S2
Mass
512.59
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Benzylethers
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzylethers
Intermediate Tree Nodes
Not available
Direct Parent
Benzylethers
Alternative Parents
Sulfuric acid monoesters Alkyl sulfates 1,3-dioxanes Thiolanes Secondary alcohols Oxacyclic compounds Dialkyl ethers Acetals Primary alcohols Organosulfur compounds Organic zwitterions Organic salts Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Benzylether - Meta-dioxane - Sulfuric acid monoester - Sulfate-ester - Sulfuric acid ester - Alkyl sulfate - Organic sulfuric acid or derivatives - Thiolane - Secondary alcohol - Acetal - Dialkyl ether - Ether - Oxacycle - Organoheterocyclic compound - Organosulfur compound - Organooxygen compound - Hydrocarbon derivative - Alcohol - Organic oxygen compound - Primary alcohol - Organic oxide - Organic salt - Organic zwitterion - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as benzylethers. These are aromatic ethers with the general formula ROCR' (R = alkyl, aryl; R'=benzene).
External Descriptors
Not available