Compound Identification
SMILES
CC(C)(\C=C\C(=O)[C@@]1(C)C[C@@H]2[C@@H]1CC[C@]1(C)O[C@H]1CCC2=C)C(O)=O
InChIKey
InChIKey=XFVIOCNOURUBAF-VFMMVDDYSA-N
Formula
C21H30O4
Mass
346.467
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
Xeniaphyllane and xenicane diterpenoids
Alternative Parents
Medium-chain fatty acids Heterocyclic fatty acids Branched fatty acids Unsaturated fatty acids Enones Acryloyl compounds Ketones Oxacyclic compounds Monocarboxylic acids and derivatives Epoxides Dialkyl ethers Carboxylic acids Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Xeniaphyllane diterpenoid - Medium-chain fatty acid - Branched fatty acid - Heterocyclic fatty acid - Fatty acyl - Fatty acid - Unsaturated fatty acid - Acryloyl-group - Enone - Alpha,beta-unsaturated ketone - Ketone - Carboxylic acid derivative - Carboxylic acid - Dialkyl ether - Oxirane - Ether - Oxacycle - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Carbonyl group - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as xeniaphyllane and xenicane diterpenoids. These are diterpenoids with a structure based either on the xeniaphyllane or the xenicane skeleton.
External Descriptors
Not available