Compound Identification
SMILES
[Na+].COC1C(O)C(CO)OC(OC2C(O)COC(OC3C(C)OC(OC4C(O[C@H]5CC[C@]6(C)[C@@H]7CCC89[C@H]([C@H](C[C@@]8(C)C7=CCC6C5(C)C)OC(C)=O)[C@](C)(C[C@@H](O)CC(C)C)OC9=O)OCC(O)C4OS([O-])(=O)=O)C(OC4OCC(O)C(O)C4O)C3O)C2O)C1O
InChIKey
InChIKey=GNUYCJPCYLCCAJ-YTLAVCNYSA-M
Formula
C60H95NaO30S
Mass
1351.44
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 Monohydroxy bile acids, alcohols and derivatives Steroid esters Hydroxysteroids O-glycosyl compounds Alkyl sulfates Dicarboxylic acids and derivatives Gamma butyrolactones Sulfuric acid monoesters Oxanes Tetrahydrofurans Secondary alcohols Carboxylic acid esters Acetals Oxacyclic compounds Dialkyl ethers Polyols Primary alcohols Hydrocarbon derivatives Carbonyl compounds Organic oxides Organic sodium salts
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Triterpenoid - Steroidal glycoside - Oligosaccharide - Hydroxy bile acid, alcohol, or derivatives - 23-hydroxysteroid - Monohydroxy bile acid, alcohol, or derivatives - Bile acid, alcohol, or derivatives - Steroid ester - Hydroxysteroid - Steroid - Glycosyl compound - O-glycosyl compound - Dicarboxylic acid or derivatives - Gamma butyrolactone - Oxane - Sulfuric acid ester - Alkyl sulfate - Sulfuric acid monoester - Sulfate-ester - Organic sulfuric acid or derivatives - Tetrahydrofuran - Carboxylic acid ester - Secondary alcohol - Lactone - Polyol - Carboxylic acid derivative - Organoheterocyclic compound - Organic alkali metal salt - Oxacycle - Dialkyl ether - Acetal - Ether - Organooxygen compound - Alcohol - Organic oxide - Hydrocarbon derivative - Primary alcohol - Organic sodium salt - Organic oxygen compound - Carbonyl group - Organic salt - 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