Compound Identification
SMILES
OC[C@H]1O[C@@H](S\C(CC2=CC3=C(N2)C=CC=C3O)=N/OS(O)(=O)=O)[C@H](O)[C@@H](O)[C@@H]1O
InChIKey
InChIKey=FGXTXTSXWKELRE-PIAXYHQTSA-N
Formula
C16H20N2O10S2
Mass
464.46
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic oxygen compounds
-
Class
Organooxygen compounds
-
Subclass
Carbohydrates and carbohydrate conjugates
-
Level 5
Monosaccharides
-
Level 6
Hexoses
-
Level 7
Glucosinolates
- Level 8 Alkylglucosinolates
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Level 7
Glucosinolates
-
Level 6
Hexoses
-
Level 5
Monosaccharides
-
Subclass
Carbohydrates and carbohydrate conjugates
-
Class
Organooxygen compounds
-
Superclass
Organic oxygen compounds
Kingdom
Organic compounds
Superclass
Organic oxygen compounds
Class
Organooxygen compounds
Subclass
Carbohydrates and carbohydrate conjugates
Intermediate Tree Nodes
Monosaccharides - Hexoses - Glucosinolates
Direct Parent
Alkylglucosinolates
Alternative Parents
Thioglycosides Hydroxyindoles Indoles 1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids Substituted pyrroles Oxanes Heteroaromatic compounds Monothioacetals Organic sulfuric acids and derivatives 1,2-diols Secondary alcohols Sulfenyl compounds Oxacyclic compounds Azacyclic compounds Primary alcohols Hydrocarbon derivatives Organic oxides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alkylglucosinolate - Glycosyl compound - S-glycosyl compound - Hydroxyindole - Indole - Indole or derivatives - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Oxane - Benzenoid - Substituted pyrrole - Heteroaromatic compound - Monothioacetal - Organic sulfuric acid or derivatives - Pyrrole - 1,2-diol - Secondary alcohol - Polyol - Sulfenyl compound - Organoheterocyclic compound - Azacycle - Oxacycle - Organosulfur compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Primary alcohol - Alcohol - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as alkylglucosinolates. These are organic compounds containing a glucosinolate moiety that carries an alkyl chain.
External Descriptors
Not available