Compound Identification
SMILES
CC(C)C(=O)OC1C(OC(=O)C2=CC=CC=C2)C(C)(C)CC2C3=CCC4C5(C)CCC(OC6OC(C(O)C(OC7OCC(O)C(O)C7O)C6OC6OC(CO)C(O)C(O)C6O)C(O)=O)C(C)(C)C5CCC4(C)C3(C)CC(O)C12CO
InChIKey
InChIKey=QWBPMBCNZGRNJF-UHFFFAOYSA-N
Formula
C58H86O22
Mass
1135.304
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 16-oxosteroids 7-hydroxysteroids Fatty acyl glycosides O-glucuronides O-glycosyl compounds Benzoic acid esters Tricarboxylic acids and derivatives Benzoyl derivatives Beta hydroxy acids and derivatives Pyrans Oxanes Secondary alcohols Cyclic alcohols and derivatives Carboxylic acid esters Polyols Acetals Oxacyclic compounds Carboxylic acids Organic oxides Hydrocarbon derivatives Carbonyl compounds Primary alcohols
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Triterpene saponin - Triterpenoid - Oligosaccharide - Hydroxysteroid - 7-hydroxysteroid - 16-oxosteroid - Oxosteroid - Steroid - Fatty acyl glycoside - 1-o-glucuronide - O-glucuronide - Glucuronic acid or derivatives - Glycosyl compound - O-glycosyl compound - Benzoate ester - Benzoic acid or derivatives - Tricarboxylic acid or derivatives - Benzoyl - Beta-hydroxy acid - Pyran - Oxane - Monocyclic benzene moiety - Benzenoid - Hydroxy acid - Fatty acyl - Cyclic alcohol - Carboxylic acid ester - Secondary alcohol - Oxacycle - Polyol - Carboxylic acid - Carboxylic acid derivative - Acetal - Organoheterocyclic compound - Hydrocarbon derivative - Organic oxide - Carbonyl group - Alcohol - Organic oxygen compound - Organooxygen compound - Primary alcohol - 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