Compound Identification
SMILES
CC(C)NCC(COC1=CC=CC=C1OCC=C)O[C@@H]1O[C@@H]([C@@H](O)[C@H](O)[C@H]1O)C(O)=O
InChIKey
InChIKey=CJVSRVDYHNLUAN-DNPGXZAYSA-N
Formula
C21H31NO9
Mass
441.477
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
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Level 7
Glucuronides
-
Level 6
Glucuronic acid derivatives
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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
O-glycosyl compounds Phenoxy compounds Phenol ethers Beta hydroxy acids and derivatives Alkyl aryl ethers Pyrans Oxanes Monosaccharides Secondary alcohols Amino acids Polyols Oxacyclic compounds Monocarboxylic acids and derivatives Dialkylamines Carboxylic acids Acetals Organopnictogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
O-glucuronide - 1-o-glucuronide - O-glycosyl compound - Glycosyl compound - Phenoxy compound - Phenol ether - Beta-hydroxy acid - Alkyl aryl ether - Benzenoid - Pyran - Oxane - Monosaccharide - Hydroxy acid - Monocyclic benzene moiety - Amino acid - Secondary alcohol - Amino acid or derivatives - Oxacycle - Organoheterocyclic compound - Secondary amine - Polyol - Monocarboxylic acid or derivatives - Ether - Secondary aliphatic amine - Carboxylic acid - Carboxylic acid derivative - Acetal - Organic nitrogen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Carbonyl group - Amine - Alcohol - Aromatic 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