Compound Identification
SMILES
CO[C@@](C(=O)O[C@@H]1C[C@H]([C@H]([C@@H]1C=O)[C@@H]1[C@H](C)C=CC1=O)C(\C)=C/CC=C(C)C)(C1=CC=CC=C1)C(F)(F)F
InChIKey
InChIKey=WCFWTSQEFYBURF-IVWYPVBGSA-N
Formula
C30H35F3O5
Mass
532.6
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
Spatane and 4,10-secospatane diterpenoids
Alternative Parents
Benzylethers Cyclic ketones Carboxylic acid esters Monocarboxylic acids and derivatives Dialkyl ethers Organofluorides Organic oxides Hydrocarbon derivatives Alkyl fluorides Aldehydes
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
4,10-secospatane diterpenoid - Benzylether - Monocyclic benzene moiety - Benzenoid - Cyclic ketone - Carboxylic acid ester - Ketone - Carboxylic acid derivative - Dialkyl ether - Ether - Monocarboxylic acid or derivatives - Organic oxide - Organohalogen compound - Organofluoride - Organooxygen compound - Organic oxygen compound - Carbonyl group - Aldehyde - Hydrocarbon derivative - Alkyl halide - Alkyl fluoride - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as spatane and 4,10-secospatane diterpenoids. These are diterpenoids with a structure based on the spatane or 4,10-secospatane skeleton. The spatane skeleton is formally derived from a prenylgermacrane by 1,5- and 6,10-cyclisation.
External Descriptors
Not available