Compound Identification
SMILES
CCC(OC1OC(C(O)C(O)C1O)C(O)=O)(C=CCl)C#C
InChIKey
InChIKey=QVPCVYXUELXQBC-UHFFFAOYSA-N
Formula
C13H17ClO7
Mass
320.72
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic oxygen compounds
-
Class
Organooxygen compounds
-
Subclass
Carbohydrates and carbohydrate conjugates
-
Level 5
Sugar acids and derivatives
-
Level 6
Glucuronic acid derivatives
-
Level 7
Glucuronides
- Level 8 O-glucuronides
-
Level 7
Glucuronides
-
Level 6
Glucuronic acid derivatives
-
Level 5
Sugar acids and derivatives
-
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
Sugar acids and derivatives - Glucuronic acid derivatives - Glucuronides
Direct Parent
O-glucuronides
Alternative Parents
Hexoses O-glycosyl compounds Beta hydroxy acids and derivatives Ynones Pyrans Oxanes Secondary alcohols Acetals Acetylides Vinyl chlorides Oxacyclic compounds Monocarboxylic acids and derivatives Polyols Chloroalkenes Carboxylic acids Hydrocarbon derivatives Organic oxides Organochlorides
Molecular Framework
Aliphatic heteromonocyclic compounds
Substituents
1-o-glucuronide - O-glucuronide - Hexose monosaccharide - Glycosyl compound - O-glycosyl compound - Beta-hydroxy acid - Hydroxy acid - Monosaccharide - Ynone - Oxane - Pyran - Secondary alcohol - Acetal - Acetylide - Carboxylic acid derivative - Carboxylic acid - Oxacycle - Monocarboxylic acid or derivatives - Chloroalkene - Polyol - Vinyl chloride - Vinyl halide - Organoheterocyclic compound - Haloalkene - Organic oxide - Hydrocarbon derivative - Carbonyl group - Organohalogen compound - Organochloride - Alcohol - Aliphatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as o-glucuronides. These are glucuronides in which the aglycone is linked to the carbohydrate unit through an O-glycosidic bond.
External Descriptors
Not available