Compound Identification
SMILES
O[C@@H]([C@@H](O)[C@H](O)C(O)=O)[C@@H](O)C(O)=O.C1CC(CN1)\C=C\C1=CC(OC2CCOCC2)=CN=C1
InChIKey
InChIKey=UTAAAINEDGZGAP-FAFKYPRASA-N
Formula
C22H32N2O10
Mass
484.502
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic oxygen compounds
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Class
Organooxygen compounds
-
Subclass
Carbohydrates and carbohydrate conjugates
-
Level 5
Sugar acids and derivatives
- 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
Direct Parent
Glucuronic acid derivatives
Alternative Parents
Medium-chain hydroxy acids and derivatives Medium-chain fatty acids Beta hydroxy acids and derivatives Hydroxy fatty acids Alkyl aryl ethers Pyridines and derivatives Oxanes Alpha hydroxy acids and derivatives Dicarboxylic acids and derivatives Monosaccharides Pyrrolidines Heteroaromatic compounds Secondary alcohols 1,2-diols Dialkyl ethers Carboxylic acids Oxacyclic compounds Dialkylamines Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Not available
Substituents
Glucuronic acid or derivatives - Medium-chain hydroxy acid - Medium-chain fatty acid - Hydroxy fatty acid - Alkyl aryl ether - Beta-hydroxy acid - Fatty acyl - Fatty acid - Alpha-hydroxy acid - Hydroxy acid - Pyridine - Monosaccharide - Dicarboxylic acid or derivatives - Oxane - Pyrrolidine - Heteroaromatic compound - 1,2-diol - Secondary alcohol - Oxacycle - Carboxylic acid derivative - Carboxylic acid - Dialkyl ether - Secondary aliphatic amine - Azacycle - Ether - Organoheterocyclic compound - Polyol - Secondary amine - Hydrocarbon derivative - Amine - Organic nitrogen compound - Carbonyl group - Alcohol - Organic oxide - Organonitrogen compound - Aromatic 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