Compound Identification
SMILES
CSCC(=O)C1=CCC[C@@H]2CC[C@H]1N2C(=O)OC(C)(C)C
InChIKey
InChIKey=VMUDXXBYVRQZHJ-DGCLKSJQSA-N
Formula
C16H25NO3S
Mass
311.44
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Alkaloids and derivatives
- Class Anatoxins
-
Superclass
Alkaloids and derivatives
Kingdom
Organic compounds
Superclass
Alkaloids and derivatives
Class
Anatoxins
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Anatoxins
Alternative Parents
Pyrrolidine carboxylic acids Azepines Carbamate esters Ketones Sulfenyl compounds Dialkylthioethers Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Anatoxin skeleton - Pyrrolidine carboxylic acid - Pyrrolidine carboxylic acid or derivatives - Azepine - Pyrrolidine - Carbamic acid ester - Ketone - Azacycle - Organoheterocyclic compound - Thioether - Dialkylthioether - Sulfenyl compound - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Organic oxygen compound - Carbonyl group - Organic oxide - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as anatoxins. These are organic compounds containing or derived from anatoxin, homoanatoxin or other analogues. Anatoxins constitute a class of potent neurotoxic alkaloids.
External Descriptors
Not available