Compound Identification
SMILES
COC(=O)C(C#N)C1=C(C(C)CC(C)(C)C1)C(SC)=C(C#N)C#N
InChIKey
InChIKey=SNAXQATUHXPAEC-UHFFFAOYSA-N
Formula
C18H21N3O2S
Mass
343.45
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Prenol lipids
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Subclass
Monoterpenoids
- Level 5 Monocyclic monoterpenoids
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Subclass
Monoterpenoids
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Class
Prenol lipids
-
Superclass
Lipids and lipid-like molecules
Kingdom
Organic compounds
Superclass
Lipids and lipid-like molecules
Class
Prenol lipids
Subclass
Monoterpenoids
Intermediate Tree Nodes
Not available
Direct Parent
Monocyclic monoterpenoids
Alternative Parents
Methyl esters Thioenol ethers Sulfenyl compounds Nitriles Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aliphatic homomonocyclic compounds
Substituents
Monocyclic monoterpenoid - Methyl ester - Carboxylic acid ester - Thioenolether - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Carbonitrile - Nitrile - Sulfenyl compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Organic oxygen compound - Organosulfur compound - Cyanide - Carbonyl group - Organic oxide - Hydrocarbon derivative - Aliphatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as monocyclic monoterpenoids. These are monoterpenoids containing 1 ring in the isoprene chain.
External Descriptors
Not available