Compound Identification
SMILES
COC(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@H](O)[C@H](O[C@@H]2O[C@H]2CC[C@@]3(C)[C@@H](CC[C@]4(C)[C@@H]3C(=O)C=C3[C@@H]5C[C@](C)(CC[C@]5(C)CC[C@@]43C)C(=O)N[C@@H](CC3=CC=CC=C3)C(=O)OC)C2(C)C)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)OC)[C@H](O)[C@@H](O)[C@@H]1O
InChIKey
InChIKey=VZVZCURKFCIYNZ-FFTWKVOBSA-N
Formula
C72H95N3O19
Mass
1306.554
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 Phenylalanine and derivatives Alpha amino acid esters N-acyl-alpha amino acids and derivatives Naphthalenecarboxamides Disaccharides O-glycosyl compounds Amphetamines and derivatives Tricarboxylic acids and derivatives Cyclohexenones Fatty acid esters Oxanes Pyrans Methyl esters Secondary carboxylic acid amides Secondary alcohols Oxacyclic compounds Polyols Acetals Organic oxides Hydrocarbon derivatives Organonitrogen compounds Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Triterpene saponin - Triterpenoid - Phenylalanine or derivatives - Alpha-amino acid ester - 2-naphthalenecarboxamide - N-acyl-alpha amino acid or derivatives - O-glycosyl compound - Disaccharide - Glycosyl compound - Alpha-amino acid or derivatives - Amphetamine or derivatives - Tricarboxylic acid or derivatives - Fatty acid ester - Cyclohexenone - Benzenoid - Fatty acyl - Oxane - Pyran - Monocyclic benzene moiety - Methyl ester - Carboxamide group - Carboxylic acid ester - Ketone - Secondary carboxylic acid amide - Secondary alcohol - Organoheterocyclic compound - Oxacycle - Carboxylic acid derivative - Acetal - Polyol - Organic nitrogen compound - Hydrocarbon derivative - Alcohol - Carbonyl group - Organic oxide - Organic oxygen compound - Organopnictogen compound - Organonitrogen compound - Organooxygen 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