Compound Identification
SMILES
CC(=O)OC[C@@]1(O)[C@@H](C[C@@H](O)[C@@H]2[C@@]3(C)CCC4=C(OC=C4)[C@@]3(C)C(=O)[C@H](O)[C@@]12COC(C)=O)OC(C)=O
InChIKey
InChIKey=CHDGXDIXZWFXLD-KTPRSJSDSA-N
Formula
C26H34O11
Mass
522.547
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
11-alpha-hydroxysteroids 14-hydroxysteroids 7-beta-hydroxysteroids Naphthofurans Tricarboxylic acids and derivatives Benzofurans Cyclitols and derivatives Tertiary alcohols Heteroaromatic compounds Furans Secondary alcohols Ketones Carboxylic acid esters Polyols Oxacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Clerodane diterpenoid - 14-hydroxysteroid - Hydroxysteroid - 7-hydroxysteroid - 7-beta-hydroxysteroid - 11-hydroxysteroid - 11-alpha-hydroxysteroid - Steroid - Naphthofuran - Benzofuran - Tricarboxylic acid or derivatives - Cyclitol or derivatives - Cyclic alcohol - Furan - Heteroaromatic compound - Tertiary alcohol - Ketone - Carboxylic acid ester - Secondary alcohol - Oxacycle - Carboxylic acid derivative - Polyol - Organoheterocyclic compound - Organooxygen compound - Hydrocarbon derivative - Organic oxygen compound - Alcohol - Carbonyl group - Organic oxide - Aromatic 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