Compound Identification
SMILES
COC(=O)[C@H]1[C@@H]2[C@@]3(C)[C@@H](OS(C)(=O)=O)C=C[C@@]2(OC3=O)[C@@H]2CC[C@@]3(C[C@]12CC3=C)OS(C)(=O)=O
InChIKey
InChIKey=UKMIJKMKEUJJNO-AXKFECAUSA-N
Formula
C22H28O10S2
Mass
516.58
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Prenol lipids
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Subclass
Terpene lactones
- Level 5 Diterpene lactones
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Subclass
Terpene lactones
-
Class
Prenol lipids
-
Superclass
Lipids and lipid-like molecules
Kingdom
Organic compounds
Superclass
Lipids and lipid-like molecules
Class
Prenol lipids
Subclass
Terpene lactones
Intermediate Tree Nodes
Not available
Direct Parent
Diterpene lactones
Alternative Parents
C19-gibberellins Sulfonic acid esters Organosulfonic acid esters Gamma butyrolactones Dicarboxylic acids and derivatives Sulfonyls Oxolanes Methyl esters Methanesulfonates Oxacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
20-norgibberellane diterpenoid - Diterpene lactone - Diterpenoid - Gibberellin - Dicarboxylic acid or derivatives - Gamma butyrolactone - Sulfonic acid ester - Organosulfonic acid ester - Methyl ester - Methanesulfonate - Oxolane - Organic sulfonic acid or derivatives - Sulfonyl - Organosulfonic acid or derivatives - Lactone - Carboxylic acid ester - Organoheterocyclic compound - Oxacycle - Carboxylic acid derivative - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Organosulfur compound - Carbonyl group - Organic oxide - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as diterpene lactones. These are diterpenoids containing a lactone moiety.
External Descriptors
Not available