Compound Identification
SMILES
[Na+].CC[C@H](C)C(=O)O[C@H]1C[C@H](O)C=C2C=C[C@H](C)[C@H](CC[C@@H](O)C[C@@H](O)CC(=O)O[C@H](C[C@H](O)CC[C@H]3[C@@H](C)C=CC4=C[C@@H](O)C[C@H](OC(=O)[C@@H](C)CC)[C@H]34)CC([O-])=O)[C@@H]12
InChIKey
InChIKey=PVVWAKDFKVDRRW-XKJCIJLMSA-M
Formula
C46H69NaO13
Mass
853.035
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Fatty Acyls
- Subclass Fatty acid esters
-
Class
Fatty Acyls
-
Superclass
Lipids and lipid-like molecules
Kingdom
Organic compounds
Superclass
Lipids and lipid-like molecules
Class
Fatty Acyls
Subclass
Fatty acid esters
Intermediate Tree Nodes
Not available
Direct Parent
3-(3-hydroxyalkanoyloxy)alkanoic acids
Alternative Parents
Tetracarboxylic acids and derivatives Beta hydroxy acids and derivatives Secondary alcohols Carboxylic acid salts Carboxylic acid esters Carboxylic acids Organic zwitterions Organic sodium salts Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aliphatic homopolycyclic compounds
Substituents
3-(3-hydroxyalkanoyloxy)alkanoic acid - Tetracarboxylic acid or derivatives - Beta-hydroxy acid - Hydroxy acid - Carboxylic acid ester - Carboxylic acid salt - Secondary alcohol - Carboxylic acid derivative - Organic alkali metal salt - Carboxylic acid - Organic oxygen compound - Organooxygen compound - Organic zwitterion - Organic salt - Organic sodium salt - Hydrocarbon derivative - Carbonyl group - Organic oxide - Alcohol - Aliphatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as 3-(3-hydroxyalkanoyloxy)alkanoic acids. These are organic compounds containing a 3-hydroxyalkanoic acid linked to another 3-hydroxyalkanoic acid through the hydroxyl group at the 3-position.
External Descriptors
Not available