Compound Identification
SMILES
CC(=O)O[C@H]1C[C@@H]2C[C@]3([C@@H](OC(C)=O)C(=O)[C@H]4C(C)(C)[C@@H](O)C[C@H](OC(C)=O)[C@]4(C)[C@H]13)C(=O)C2=C
InChIKey
InChIKey=WQVYSFSBBFDGRG-GDRCMEQOSA-N
Formula
C26H34O9
Mass
490.549
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Prenol lipids
-
Subclass
Diterpenoids
- Level 5 Kaurane diterpenoids
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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
Not available
Direct Parent
Kaurane diterpenoids
Alternative Parents
Tricarboxylic acids and derivatives Alpha-acyloxy ketones Secondary alcohols Ketones Cyclic alcohols and derivatives Carboxylic acid esters Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic homopolycyclic compounds
Substituents
Kaurane diterpenoid - Tricarboxylic acid or derivatives - Alpha-acyloxy ketone - Cyclic alcohol - Secondary alcohol - Ketone - Carboxylic acid ester - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Alcohol - Aliphatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as kaurane diterpenoids. These are diterpene alkaloids with a structure that is based on the kaurane skeleton. Kaurane is a tetracyclic compound that arises by cyclisation of a pimarane precursor followed by rearrangement. It possesses a [3,2,1]-bicyclic ring system with C15-C16 bridge connected to C13, forming the five-membered ring D.
External Descriptors
Not available