Compound Identification
SMILES
C[C@H]1O[C@H](O[C@@H]2[C@@H](O)C[C@@H](CO)O[C@H]2OC(=O)[C@]2(C)CCC[C@@]3(C)[C@@H]4CC[C@@]5(C[C@]4(CC5=C)CC[C@H]23)O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H](O)[C@@H]1O
InChIKey
InChIKey=HQGXKNPPPPDNSI-GJALRPLPSA-N
Formula
C44H70O21
Mass
935.023
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 O-glycosyl compounds Disaccharides Oxanes Secondary alcohols Carboxylic acid esters Polyols Oxacyclic compounds Monocarboxylic acids and derivatives Acetals Primary alcohols Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Steviol glycoside - Kaurane diterpenoid - Diterpenoid - Fatty acyl glycoside of mono- or disaccharide - Fatty acyl glycoside - O-glycosyl compound - Glycosyl compound - Disaccharide - Fatty acyl - Oxane - Secondary alcohol - Carboxylic acid ester - Oxacycle - Organoheterocyclic compound - Polyol - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Acetal - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Primary alcohol - Organooxygen compound - Carbonyl group - Alcohol - 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