Compound Identification
SMILES
C[C@@H]1OC(OC2C(O[C@@H]3[C@H](OC4[C@H](O)C(O[C@@H](O[C@H]5CC[C@@]6(C)C(CC[C@]7(C)C6CC[C@]68O[C@H](O)[C@]9(C6CC(C)(C)[C@@H](OC(=O)C6=CC=CC=C6)[C@@H]9OC(=O)\C=C\C6=CC=CC=C6)[C@@H](C[C@@]78C)OC(C)=O)C5(C)C)[C@H]4O[C@@H]4OC(CO)[C@@H](O)C(O)[C@@H]4O)C(O)=O)OC(CO)[C@H](O)C3O)O[C@@H](C)C(O)[C@@H]2O)[C@@H](O)C(O)[C@H]1O
InChIKey
InChIKey=SDSGKYIXHUFPHL-VFXCZWRFSA-N
Formula
C78H110O33
Mass
1575.705
Taxonomic Classification
Taxonomy Tree
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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 Fatty acyl glycosides O-glucuronides Tetracarboxylic acids and derivatives Cinnamic acid esters O-glycosyl compounds Benzoic acid esters Benzoyl derivatives Styrenes Oxepanes Beta hydroxy acids and derivatives Fatty acid esters Oxanes Pyrans Tetrahydrofurans Enoate esters Secondary alcohols Hemiacetals Polyols Oxacyclic compounds Carboxylic acids Acetals Carbonyl compounds Primary alcohols Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Triterpene saponin - Triterpenoid - Oligosaccharide - Fatty acyl glycoside - 1-o-glucuronide - O-glucuronide - Glucuronic acid or derivatives - Tetracarboxylic acid or derivatives - Cinnamic acid or derivatives - Cinnamic acid ester - Glycosyl compound - O-glycosyl compound - Benzoate ester - Benzoic acid or derivatives - Styrene - Benzoyl - Beta-hydroxy acid - Fatty acid ester - Oxepane - Fatty acyl - Pyran - Monocyclic benzene moiety - Oxane - Hydroxy acid - Benzenoid - Tetrahydrofuran - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Secondary alcohol - Hemiacetal - Carboxylic acid ester - Polyol - Organoheterocyclic compound - Carboxylic acid derivative - Oxacycle - Carboxylic acid - Acetal - Organic oxide - Carbonyl group - Hydrocarbon derivative - Alcohol - Organooxygen compound - Primary alcohol - Organic oxygen compound - Aromatic 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