Compound Identification
SMILES
[Na+].OCCCC([O-])=O.OC[C@H]1OC(=O)[C@H](O)[C@@H](O)[C@@H]1O
InChIKey
InChIKey=HTYSOQYUGSGYCL-ZBHRUSISSA-M
Formula
C10H17NaO9
Mass
304.227
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic oxygen compounds
-
Class
Organooxygen compounds
-
Subclass
Carbohydrates and carbohydrate conjugates
-
Level 5
Monosaccharides
-
Level 6
Hexoses
- Level 7 Gluconolactones
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Level 6
Hexoses
-
Level 5
Monosaccharides
-
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
Monosaccharides - Hexoses
Direct Parent
Gluconolactones
Alternative Parents
Short-chain hydroxy acids and derivatives Delta valerolactones Hydroxy fatty acids Straight chain fatty acids Oxanes Secondary alcohols 1,2-diols Carboxylic acid esters Carboxylic acid salts Oxacyclic compounds Carboxylic acids Monocarboxylic acids and derivatives Organic sodium salts Carbonyl compounds Organic zwitterions Hydrocarbon derivatives Organic oxides Primary alcohols
Molecular Framework
Not available
Substituents
Gluconolactone - Delta valerolactone - Hydroxy fatty acid - Delta_valerolactone - Short-chain hydroxy acid - Fatty acyl - Fatty acid - Straight chain fatty acid - Oxane - 1,2-diol - Carboxylic acid ester - Carboxylic acid salt - Lactone - Secondary alcohol - Carboxylic acid derivative - Oxacycle - Carboxylic acid - Organic alkali metal salt - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Polyol - Carbonyl group - Organic sodium salt - Organic oxide - Organic salt - Organic zwitterion - Hydrocarbon derivative - Primary alcohol - Alcohol - Aliphatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as gluconolactones. These are polyhydroxy acids containing a gluconolactone molecule, which is characterized by a tetrahydropyran substituted by three hydroxyl groups, one ketone group, and one hydroxymethyl group.
External Descriptors
Not available