Compound Identification
SMILES
CCC(C)(C)C(=O)O[C@H]1CCC[C@@H]2C=C[C@H](C)[C@H](COP(O)(=O)C[C@@H](O)CC(O)=O)[C@@H]12
InChIKey
InChIKey=DXFWTOWGCGVTML-VBXOEGAOSA-N
Formula
C22H37O8P
Mass
460.504
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
Class
Hydroxy acids and derivatives
- Subclass Beta hydroxy acids and derivatives
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Class
Hydroxy acids and derivatives
-
Superclass
Organic acids and derivatives
Kingdom
Organic compounds
Superclass
Organic acids and derivatives
Class
Hydroxy acids and derivatives
Subclass
Beta hydroxy acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Beta hydroxy acids and derivatives
Alternative Parents
Short-chain hydroxy acids and derivatives Fatty acid esters Phosphonic acid esters Dicarboxylic acids and derivatives Organic phosphonic acids Secondary alcohols Carboxylic acid esters Carboxylic acids Organophosphorus compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aliphatic homopolycyclic compounds
Substituents
Beta-hydroxy acid - Fatty acid ester - Short-chain hydroxy acid - Dicarboxylic acid or derivatives - Fatty acyl - Phosphonic acid ester - Organophosphonic acid - Organophosphonic acid derivative - Carboxylic acid ester - Secondary alcohol - Carboxylic acid - Carboxylic acid derivative - Organooxygen compound - Alcohol - Hydrocarbon derivative - Organic oxide - Carbonyl group - Organic oxygen compound - Organophosphorus compound - Aliphatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as beta hydroxy acids and derivatives. These are compounds containing a carboxylic acid substituted with a hydroxyl group on the C3 carbon atom.
External Descriptors
Not available