Compound Identification
SMILES
[Na+].C[C@@]12CCC[C@](C)([C@H]1CC[C@@]13CC(=C)[C@@](C1)(CC[C@@H]23)O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)C(=O)OCCCS([O-])(=O)=O
InChIKey
InChIKey=LFQMWSLSFAEKHI-FVLJKROWSA-M
Formula
C35H55NaO16S
Mass
786.86
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Prenol lipids
-
Subclass
Terpene glycosides
-
Level 5
Diterpene glycosides
- Level 6 Steviol glycosides
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Level 5
Diterpene glycosides
-
Subclass
Terpene glycosides
-
Class
Prenol lipids
-
Superclass
Lipids and lipid-like molecules
Kingdom
Organic compounds
Superclass
Lipids and lipid-like molecules
Class
Prenol lipids
Subclass
Terpene glycosides
Intermediate Tree Nodes
Diterpene glycosides
Direct Parent
Steviol glycosides
Alternative Parents
Kaurane diterpenoids Fatty acyl glycosides of mono- and disaccharides Disaccharides O-glycosyl compounds Oxanes Organosulfonic acids Sulfonyls Alkanesulfonic acids Secondary alcohols Carboxylic acid esters Oxacyclic compounds Polyols Monocarboxylic acids and derivatives Acetals Organic sodium salts Organic oxides Primary alcohols Hydrocarbon derivatives Carbonyl compounds Organic cations
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Steviol glycoside - Diterpenoid - Kaurane diterpenoid - Fatty acyl glycoside - Fatty acyl glycoside of mono- or disaccharide - Disaccharide - Glycosyl compound - O-glycosyl compound - Fatty acyl - Oxane - Organic sulfonic acid or derivatives - Alkanesulfonic acid - Sulfonyl - Organosulfonic acid - Organosulfonic acid or derivatives - Carboxylic acid ester - Secondary alcohol - Carboxylic acid derivative - Acetal - Oxacycle - Organic alkali metal salt - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Polyol - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic sodium salt - Organooxygen compound - Organosulfur compound - Organic salt - Organic oxygen compound - Primary alcohol - Alcohol - Organic cation - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as steviol glycosides. These are prenol lipids containing a carbohydrate moiety glycosidically linked to a steviol (a diterpenoid based on a 13-Hydroxykaur-16-en-18-oic acid) moiety.
External Descriptors
Not available