Compound Identification
SMILES
CC(=O)NC1C(CC(OC1C(O)C(O)CO)C(O)=O)N=C(N)N
InChIKey
InChIKey=DAAUVSVERFXBSX-UHFFFAOYSA-N
Formula
C12H22N4O7
Mass
334.329
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 C-glucuronides
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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
C-glucuronides
Alternative Parents
Gamma amino acids and derivatives C-glycosyl compounds Pyrans Oxanes Acetamides Secondary carboxylic acid amides Secondary alcohols Guanidines Propargyl-type 1,3-dipolar organic compounds Carboximidamides Carboxylic acids Dialkyl ethers Monocarboxylic acids and derivatives Oxacyclic compounds Polyols Primary alcohols Hydrocarbon derivatives Carbonyl compounds Organic oxides
Molecular Framework
Aliphatic heteromonocyclic compounds
Substituents
C-glucuronide - Gamma amino acid or derivatives - C-glycosyl compound - Glycosyl compound - Oxane - Pyran - Acetamide - Carboxamide group - Guanidine - Secondary carboxylic acid amide - Secondary alcohol - Carboxylic acid derivative - Carboxylic acid - Dialkyl ether - Ether - Oxacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Monocarboxylic acid or derivatives - Carboximidamide - Polyol - Propargyl-type 1,3-dipolar organic compound - Hydrocarbon derivative - Alcohol - Organonitrogen compound - Organic nitrogen compound - Organic oxide - Primary alcohol - Carbonyl group - Aliphatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as c-glucuronides. These are glucuronides in which the aglycone is linked to the carbohydrate unit through a C-glycosidic bond.
External Descriptors
Not available