Compound Identification
SMILES
CC1=C(C)CC(SCC(O)=O)(SC1)C(O)=O
InChIKey
InChIKey=YXCNHFWPIRONER-UHFFFAOYSA-N
Formula
C10H14O4S2
Mass
262.34
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
Class
Carboxylic acids and derivatives
-
Subclass
Dicarboxylic acids and derivatives
- Level 5 Thiodiacetic acid derivatives
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Subclass
Dicarboxylic acids and derivatives
-
Class
Carboxylic acids and derivatives
-
Superclass
Organic acids and derivatives
Kingdom
Organic compounds
Superclass
Organic acids and derivatives
Class
Carboxylic acids and derivatives
Subclass
Dicarboxylic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Thiodiacetic acid derivatives
Alternative Parents
Heterocyclic fatty acids Dithioketals Thiopyrans Sulfenyl compounds Dialkylthioethers Carboxylic acids Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aliphatic heteromonocyclic compounds
Substituents
Thiodiacetic_acid - Dithioketal - Heterocyclic fatty acid - Fatty acyl - Thiopyran - Thioacetal - Carboxylic acid - Organoheterocyclic compound - Thioether - Dialkylthioether - Sulfenyl compound - Organooxygen compound - Hydrocarbon derivative - Organosulfur compound - Carbonyl group - Organic oxygen compound - Organic oxide - Aliphatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as thiodiacetic acid derivatives. These are compounds containing a thiodiacetic acid group (or esters/salts thereof) which is made up of two 2-sulfanylacetic (OC(=O)CS) acid moieties sharing their sulfur atom.
External Descriptors
Not available