Compound Identification
SMILES
CC(C)C1=C[C@]23CC[C@H]4[C@](C)(CCC[C@@]4(C)C([O-])=O)[C@@H]2C[C@H]1[C@@H]1[C@H]3C(=O)N(C1=O)C1=CC=CC(C)=C1
InChIKey
InChIKey=MRRXYEYSIFOGFP-MKDDCPFHSA-M
Formula
C31H38NO4
Mass
488.649
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
Villanovane, atisane, trachylobane or helvifulvane diterpenoids
Direct Parent
Atisane diterpenoids
Alternative Parents
Phenylpyrrolidines Isoindolones Alkaloids and derivatives Toluenes Pyrrolidine-2-ones N-substituted carboxylic acid imides Pyrroles Dicarboximides Carboxylic acid salts Lactams Azacyclic compounds Carboxylic acids Monocarboxylic acids and derivatives Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds Organic anions
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Atisane diterpenoid - 1-phenylpyrrolidine - Isoindolone - Isoindoline - Isoindole or derivatives - Alkaloid or derivatives - Toluene - Monocyclic benzene moiety - Carboxylic acid imide, n-substituted - Benzenoid - 2-pyrrolidone - Pyrrolidone - Carboxylic acid imide - Dicarboximide - Pyrrole - Pyrrolidine - Lactam - Carboxylic acid salt - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Azacycle - Carboxylic acid - Carboxylic acid derivative - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Organooxygen compound - Organic oxygen compound - Carbonyl group - Organic anion - Aromatic heteropolycyclic 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