Compound Identification
SMILES
CC1O[C@@H](OCC2[C@@H](O)C(CO)OC(O)C2CO[C@@H]2OC([C@H](COC[C@@H]3OC(CO)[C@H](O)C(CO[C@@H]4OC(C)[C@H](O)C(OS(O)(=O)=O)C4O)C3CO[C@@H]3OC(=CC(O)C3O)C(O)=O)C(O)C2O)C(O)=O)C(O)C(OS(O)(=O)=O)[C@H]1O
InChIKey
InChIKey=FTOBLMSBIHXTFR-VMDXVIBTSA-N
Formula
C42H68O36S2
Mass
1213.09
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 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
Direct Parent
Glucuronic acid derivatives
Alternative Parents
C-glycosyl compounds O-glycosyl compounds Alkyl sulfates Sulfuric acid monoesters Dicarboxylic acids and derivatives Monosaccharides Oxanes Pyrans Hemiacetals Secondary alcohols Acetals Oxacyclic compounds Carboxylic acids Dialkyl ethers Carbonyl compounds Hydrocarbon derivatives Organic oxides Primary alcohols
Molecular Framework
Aliphatic heteromonocyclic compounds
Substituents
Glucuronic acid or derivatives - C-glycosyl compound - Glycosyl compound - O-glycosyl compound - Dicarboxylic acid or derivatives - Monosaccharide - Oxane - Pyran - Sulfuric acid monoester - Sulfate-ester - Alkyl sulfate - Sulfuric acid ester - Organic sulfuric acid or derivatives - Hemiacetal - Secondary alcohol - Organoheterocyclic compound - Oxacycle - Ether - Acetal - Carboxylic acid derivative - Carboxylic acid - Dialkyl ether - Alcohol - Hydrocarbon derivative - Primary alcohol - Organic oxide - Carbonyl group - Aliphatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as glucuronic acid derivatives. These are compounds containing a glucuronic acid moiety (or a derivative), which consists of a glucose moiety with the C6 carbon oxidized to a carboxylic acid.
External Descriptors
Not available