Compound Identification
SMILES
COC(=O)C1OC(OC2CCC3(C)C(CCC4(C)C3CC=C3C5CC(C)(C)CCC5(C(O)CC43C)C(=O)OC3OCC(O)C(O)C3OC(=O)C=CC3=CC(OC)=C(OC4OC(CO)C(O)C(O)C4O)C=C3)C2(C)C)C(O)C(O)C1O
InChIKey
InChIKey=FQDYAELZPDIZMA-UHFFFAOYSA-N
Formula
C58H84O22
Mass
1133.288
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 Phenolic glycosides O-glucuronides Cinnamic acid esters Coumaric acids and derivatives O-glycosyl compounds Tricarboxylic acids and derivatives Styrenes Anisoles Phenoxy compounds Methoxybenzenes Alkyl aryl ethers Fatty acid esters Beta hydroxy acids and derivatives Pyrans Oxanes Monosaccharides Methyl esters Enoate esters Secondary alcohols Cyclic alcohols and derivatives Oxacyclic compounds Polyols Acetals Organic oxides Carbonyl compounds Primary alcohols Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Triterpene saponin - Triterpenoid - Phenolic glycoside - 1-o-glucuronide - O-glucuronide - Glucuronic acid or derivatives - Cinnamic acid or derivatives - Coumaric acid or derivatives - Cinnamic acid ester - Glycosyl compound - O-glycosyl compound - Tricarboxylic acid or derivatives - Phenoxy compound - Phenol ether - Anisole - Styrene - Methoxybenzene - Beta-hydroxy acid - Fatty acid ester - Alkyl aryl ether - Benzenoid - Monosaccharide - Pyran - Monocyclic benzene moiety - Hydroxy acid - Oxane - Fatty acyl - Cyclic alcohol - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Methyl ester - Secondary alcohol - Carboxylic acid ester - Ether - Acetal - Carboxylic acid derivative - Polyol - Oxacycle - Organoheterocyclic compound - Organooxygen compound - Alcohol - Hydrocarbon derivative - Carbonyl group - Primary alcohol - Organic oxide - 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