Compound Identification
SMILES
CC1(C)CCC[C@@]2(C)[C@H]1CC[C@@]1(C=O)[C@H](C=O)[C+](CO[B-](F)(F)F)CC[C@H]21
InChIKey
InChIKey=HWAFIVZPCNSKDH-FPPGBKCQSA-N
Formula
C20H30BF3O3
Mass
386.26
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
Not available
Direct Parent
Isocopalane and spongiane diterpenoids
Alternative Parents
Steroids and steroid derivatives Hydrophenanthrenes Organic metalloid salts Organic zwitterions Organic oxides Hydrocarbon derivatives Aldehydes
Molecular Framework
Aliphatic homopolycyclic compounds
Substituents
Isocopalane diterpenoid - Steroid - Phenanthrene - Hydrophenanthrene - Organic metalloid salt - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organic salt - Organic zwitterion - Organooxygen compound - Carbonyl group - Aldehyde - Aliphatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as isocopalane and spongiane diterpenoids. These are diterpenoids with a structure based on the isocopalane (Tetradecahydro-1,1,4a,7,8,8a-hexamethylphenanthrene) or the 15,16-epoxyisocopalane skeleton.
External Descriptors
Not available