Compound Identification
SMILES
CC(=O)OCC1OC(OC2C(O)C(COC2OCC2OC(OC3CCC4(C)C(CCC5(C)C4CC=C4C6CC(C)(C)CCC6(C(O)C(O)C54C)C(=O)OC4OC(CO)C(O)C(OC(=O)C(\C)=C\CCC(C)(O)C=C)C4OC4OCC(OC5OCC(O)C(OC6OCC(O)C(O)C6O)C5O)C(O)C4O)C3(C)C)C(OC3OCC(O)C(O)C3O)C(O)C2O)OC(C)=O)C(OC(C)=O)C(O)C1O
InChIKey
InChIKey=XDSAOPQKLCNCGB-QNVXDBMFSA-N
Formula
C89H138O45
Mass
1928.038
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Lipids and lipid-like molecules
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Class
Prenol lipids
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Subclass
Terpene glycosides
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Level 5
Triterpene glycosides
- Level 6 Triterpene saponins
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Level 5
Triterpene glycosides
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Subclass
Terpene glycosides
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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 glycosides
Intermediate Tree Nodes
Triterpene glycosides
Direct Parent
Triterpene saponins
Alternative Parents
Triterpenoids Oligosaccharides Saccharolipids Pentacarboxylic acids and derivatives Fatty acyl glycosides O-glycosyl compounds Beta hydroxy acids and derivatives Fatty acid esters Oxanes Tertiary alcohols Enoate esters Secondary alcohols Cyclic alcohols and derivatives Acetals Polyols Oxacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Primary alcohols
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Triterpene saponin - Triterpenoid - Oligosaccharide - Saccharolipid - Pentacarboxylic acid or derivatives - Fatty acyl glycoside - Glycosyl compound - O-glycosyl compound - Beta-hydroxy acid - Fatty acid ester - Hydroxy acid - Oxane - Fatty acyl - Tertiary alcohol - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Cyclic alcohol - Secondary alcohol - Carboxylic acid ester - Organoheterocyclic compound - Polyol - Oxacycle - Acetal - Carboxylic acid derivative - Primary alcohol - Alcohol - Organic oxygen compound - Organic oxide - Carbonyl group - Hydrocarbon derivative - Organooxygen compound - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as triterpene saponins. These are glycosylated derivatives of triterpene sapogenins. The sapogenin moiety backbone is usually based on the oleanane, ursane, taraxastane, bauerane, lanostane, lupeol, lupane, dammarane, cycloartane, friedelane, hopane, 9b,19-cyclo-lanostane, cycloartane, or cycloartanol skeleton.
External Descriptors
Not available