Compound Identification
SMILES
[K+].OC[C@H]1O[C@@H](S\C(CC2=CC=C(O)C=C2)=N/OS([O-])(=O)=O)[C@H](O)[C@@H](O)[C@@H]1O
InChIKey
InChIKey=LAMNAIMKLRHPRP-UDQIAKBUSA-M
Formula
C14H18KNO10S2
Mass
463.51
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 1-hydroxy-2-unsubstituted benzenoids Benzene and substituted derivatives Oxanes Monothioacetals Organic sulfuric acids and derivatives 1,2-diols Secondary alcohols Sulfenyl compounds Oxacyclic compounds Organonitrogen compounds Organic potassium salts Organic oxides Hydrocarbon derivatives Primary alcohols Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alkylglucosinolate - Glycosyl compound - S-glycosyl compound - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Monocyclic benzene moiety - Benzenoid - Oxane - Monothioacetal - Organic sulfuric acid or derivatives - 1,2-diol - Secondary alcohol - Sulfenyl compound - Organoheterocyclic compound - Organic alkali metal salt - Oxacycle - Polyol - Organic nitrogen compound - Alcohol - Primary alcohol - Organosulfur compound - Organonitrogen compound - Organic salt - Organic potassium salt - Hydrocarbon derivative - Organic oxide - Organic cation - Aromatic 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