Compound Identification
SMILES
[H]O[C@@]1([H])O[C@@]([H])(C([H])([H])[C@@]2(C([H])([H])[H])[C@]([H])(C([H])([H])[H])[C@]([H])(O[H])C(=O)[C@]3(C(=C([H])C([H])([H])C([H])([H])[C@@]23[H])C([H])([H])[H])C([H])([H])[H])[C@@]2(OC2([H])[H])[C@]1([H])O[H]
InChIKey
InChIKey=BHDYBYAEPPUJEJ-IORSCIEGSA-N
Formula
C20H30O6
Mass
366.454
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
Colensane and clerodane diterpenoids
Alternative Parents
Acyloins Tetrahydrofurans Alpha-hydroxy ketones Secondary alcohols Cyclic alcohols and derivatives Oxacyclic compounds Epoxides Dialkyl ethers Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Clerodane diterpenoid - Acyloin - Tetrahydrofuran - Cyclic alcohol - Alpha-hydroxy ketone - Secondary alcohol - Ketone - Oxacycle - Organoheterocyclic compound - Ether - Oxirane - Dialkyl ether - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Alcohol - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as colensane and clerodane diterpenoids. These are diterpenoids with a structure based on the clerodane or the colensane skeleton. Clerodanes arise from labdanes by two methyl migrations.
External Descriptors
Not available