Compound Identification
SMILES
CC1(C)SC(C(S1)C(=O)NCCNCCNC(=O)C1SC(C)(C)SC1C(O)=O)C(O)=O
InChIKey
InChIKey=HYMVUIRLPNEADI-UHFFFAOYSA-N
Formula
C18H29N3O6S4
Mass
511.69
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Dithiolanes
-
Subclass
Dithiolanecarboxylic acids
- Level 5 1,3-dithiolanecarboxylic acids
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Subclass
Dithiolanecarboxylic acids
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Class
Dithiolanes
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Dithiolanes
Subclass
Dithiolanecarboxylic acids
Intermediate Tree Nodes
1,3-dithiolanecarboxylic acids
Direct Parent
1,3-dithiolane-4-carboxylic acids
Alternative Parents
Dithioketals Dicarboxylic acids and derivatives 1,3-dithiolanes Secondary carboxylic acid amides Amino acids Dialkylthioethers Dialkylamines Carboxylic acids Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aliphatic heteromonocyclic compounds
Substituents
1,3-dithiolane-4-carboxylic acid - Dithioketal - Dicarboxylic acid or derivatives - Thioacetal - 1,3-dithiolane - Amino acid or derivatives - Carboxamide group - Amino acid - Secondary carboxylic acid amide - Carboxylic acid derivative - Carboxylic acid - Secondary aliphatic amine - Dialkylthioether - Secondary amine - Thioether - Organic oxide - Organic nitrogen compound - Amine - Hydrocarbon derivative - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Aliphatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as 1,3-dithiolane-4-carboxylic acids. These are organic compounds containing a 1,2-dithiolane ring that bears a carboxylic acid group at the 4-position.
External Descriptors
Not available