Compound Identification
SMILES
CCCNCCN(C)CCNC(=O)C1C(C2CC3[C@@]4(C)CCC[C@](C)(C4CCC13C=C2C(C)C)C(O)=O)C(O)=O
InChIKey
InChIKey=KJSIBWXBBLFBJR-VSEIFRRFSA-N
Formula
C32H53N3O5
Mass
559.792
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Prenol lipids
- Subclass Diterpenoids
-
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
Villanovane, atisane, trachylobane or helvifulvane diterpenoids
Direct Parent
Atisane diterpenoids
Alternative Parents
Naphthalenecarboxamides Alkaloids and derivatives Dicarboxylic acids and derivatives Trialkylamines Secondary carboxylic acid amides Amino acids Dialkylamines Carboxylic acids Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aliphatic homopolycyclic compounds
Substituents
Atisane diterpenoid - 1-naphthalenecarboxamide - Alkaloid or derivatives - Dicarboxylic acid or derivatives - Amino acid or derivatives - Carboxamide group - Secondary carboxylic acid amide - Tertiary amine - Tertiary aliphatic amine - Amino acid - Secondary aliphatic amine - Carboxylic acid - Carboxylic acid derivative - Secondary amine - Organooxygen compound - Organonitrogen compound - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Amine - Hydrocarbon derivative - Aliphatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as atisane diterpenoids. These are diterpenoids with a structure based on the atisane skeleton, which is a tetracyclic compound containing the [2,2,2]bicyc1ic ring system with the C15-C16 bridge attached at C12.
External Descriptors
Not available