Compound Identification
SMILES
CC(C)(C)C1CC2C(C1)C(C#N)C1CC(CC1C2C#N)C(C)(C)C
InChIKey
InChIKey=HRCUZCZIVWADDD-UHFFFAOYSA-N
Formula
C22H34N2
Mass
326.528
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Prenol lipids
- Subclass Diterpenoids
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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
Diterpenoids
Intermediate Tree Nodes
Not available
Direct Parent
Ileabethane, pseudopterane or nor-sandresane diterpenoids
Alternative Parents
Molecular Framework
Aliphatic homopolycyclic compounds
Substituents
Ileabethane, pseudopterane or nor-sandresane diterpenoid - Nitrile - Carbonitrile - Organic nitrogen compound - Cyanide - Hydrocarbon derivative - Organonitrogen compound - Aliphatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as ileabethane, pseudopterane or nor-sandresane diterpenoids. These are diterpenoids with a structure based on either the ileabethane, the pseudopterane, or the nor-sandresane skeleton. Ileabethane is a tricyclic carbon skeleton arising from the C8-C14 of serrulatane. In the nor-sandresane skeleton, a cyclohexane ring is fused to a seven-membered saturated aliphatic carbocycle, which could stem from the rearrangement of an amphilectane-based precursor involving loss of a carbon atom and a 1,2-alkyl shift with ring expansion.
External Descriptors
Not available