Compound Identification
SMILES
CS(=O)CCC\C(S[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)=N/OS([O-])(=O)=O
InChIKey
InChIKey=PHYYADMVYQURSX-WWFIZPDBSA-M
Formula
C11H20NO10S3
Mass
422.46
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 Oxanes Monothioacetals Organic sulfuric acids and derivatives Secondary alcohols Sulfoxides Polyols Oxacyclic compounds Sulfenyl compounds Sulfinyl compounds Primary alcohols Organopnictogen compounds Organonitrogen compounds Hydrocarbon derivatives Organic oxides Organic anions
Molecular Framework
Aliphatic heteromonocyclic compounds
Substituents
Alkylglucosinolate - Glycosyl compound - S-glycosyl compound - Oxane - Monothioacetal - Organic sulfuric acid or derivatives - Secondary alcohol - Sulfoxide - Polyol - Oxacycle - Organoheterocyclic compound - Sulfinyl compound - Sulfenyl compound - Primary alcohol - Alcohol - Hydrocarbon derivative - Organosulfur compound - Organonitrogen compound - Organic nitrogen compound - Organopnictogen compound - Organic oxide - Organic anion - Aliphatic heteromonocyclic 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