Compound Identification
SMILES
[Na+].COC1[C@H](O)C(CO)C[C@@H](OC2[C@H](O)CO[C@@H](O[C@@H]3C(C)O[C@@H](OC4C(O)[C@@H](CO[C@H]4OC4CC[C@@]5(C)C6CCC78[C@H](C(C[C@@]7(C)C6=CCC5C4(C)C)OC(C)=O)[C@](C)(CCC=C(C)C)OC8=O)OS([O-])(=O)=O)C(O)C3O)C2O)C1O
InChIKey
InChIKey=WKSHRFGJPBGGPF-PJPCJCHWSA-M
Formula
C56H87NaO24S
Mass
1199.34
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Prenol lipids
- Subclass Triterpenoids
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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
Triterpenoids
Intermediate Tree Nodes
Not available
Direct Parent
Triterpenoids
Alternative Parents
Steroidal glycosides Oligosaccharides Steroid esters O-glycosyl compounds Cyclohexanols Oxanes Sulfuric acid monoesters Gamma butyrolactones Dicarboxylic acids and derivatives Cyclitols and derivatives Alkyl sulfates Tetrahydrofurans Carboxylic acid esters Oxacyclic compounds Dialkyl ethers Acetals Organic sodium salts Organic oxides Hydrocarbon derivatives Carbonyl compounds Primary alcohols
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Triterpenoid - Steroidal glycoside - Oligosaccharide - Steroid ester - Glycosyl compound - O-glycosyl compound - Cyclohexanol - Cyclitol or derivatives - Dicarboxylic acid or derivatives - Gamma butyrolactone - Oxane - Sulfuric acid monoester - Sulfate-ester - Alkyl sulfate - Sulfuric acid ester - Cyclic alcohol - Tetrahydrofuran - Organic sulfuric acid or derivatives - Secondary alcohol - Carboxylic acid ester - Lactone - Organic alkali metal salt - Organoheterocyclic compound - Acetal - Carboxylic acid derivative - Dialkyl ether - Ether - Oxacycle - Primary alcohol - Organic oxygen compound - Organic sodium salt - Alcohol - Organic salt - Organic oxide - Organooxygen compound - Hydrocarbon derivative - Carbonyl group - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as triterpenoids. These are terpene molecules containing six isoprene units.
External Descriptors
Not available