Compound Identification
SMILES
[Ca++].C\C(=C/C=C/[C@@]1(C)OC(=O)[C@@]23CC[C@@H]1[C@@]2([O-])CCC(=CC3)C([O-])=O)C(=O)NC1=NC=CS1
InChIKey
InChIKey=FRQUZBZDKOJTHP-AOLYSOLSSA-M
Formula
C23H24CaN2O6S
Mass
496.59
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
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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
Terpene lactones
Intermediate Tree Nodes
Not available
Direct Parent
Diterpene lactones
Alternative Parents
Sphenolobane diterpenoids N-arylamides Delta valerolactones Oxepanes Dicarboxylic acids and derivatives Oxanes Heteroaromatic compounds Thiazoles Secondary carboxylic acid amides Carboxylic acid salts Carboxylic acid esters Organic calcium salts Carboxylic acids Oxacyclic compounds Azacyclic compounds Organic zwitterions Organic oxides Hydrocarbon derivatives Alkoxides Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Diterpene lactone - Diterpenoid - Prenyldaucane diterpenoid - Caprolactone - N-arylamide - Oxepane - Delta valerolactone - Delta_valerolactone - Oxane - Dicarboxylic acid or derivatives - Azole - Thiazole - Heteroaromatic compound - Lactone - Carboxylic acid salt - Secondary carboxylic acid amide - Carboxylic acid ester - Carboxamide group - Organic calcium salt - Carboxylic acid derivative - Carboxylic acid - Oxacycle - Azacycle - Organoheterocyclic compound - Carbonyl group - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Organic salt - Organic zwitterion - Alkoxide - Organonitrogen compound - Organooxygen compound - Aromatic 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