Compound Identification
SMILES
C[C@@H]1CC[C@H]2[C@@H]1[C@@H]1[C@@H](C[C@@H](O)[C@]21C)C(=C)C(=O)\C=C\C(C)(O)COC(C)=O
InChIKey
InChIKey=VTYAVRSWNWGQOP-HGNCOORGSA-N
Formula
C22H32O5
Mass
376.493
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
Alpha-branched alpha,beta-unsaturated ketones Tertiary alcohols Enones Acryloyl compounds Secondary alcohols Ketones Cyclic alcohols and derivatives Carboxylic acid esters Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic homopolycyclic compounds
Substituents
Spatane diterpenoid - Alpha-branched alpha,beta-unsaturated-ketone - Acryloyl-group - Cyclic alcohol - Alpha,beta-unsaturated ketone - Tertiary alcohol - Enone - Carboxylic acid ester - Secondary alcohol - Ketone - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Carbonyl group - Organooxygen compound - Alcohol - Aliphatic homopolycyclic 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