Compound Identification
SMILES
CC(=O)OC1OC(C(OC2C(OC3CCC4(C)C(CCC5(C)C4C(=O)C=C4C6CC(C)(CCC6(C)CCC54C)C(=O)N4CCOCC4)C3(C)C)OC(C(OC(C)=O)C2OC(C)=O)C(=O)N2CCOCC2)C(OC(C)=O)C1OC(C)=O)C(=O)N1CCOCC1
InChIKey
InChIKey=PYHZVCPVEQVHIJ-UHFFFAOYSA-N
Formula
C64H93N3O21
Mass
1240.448
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
-
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 Pentacarboxylic acids and derivatives Naphthalenecarboxamides O-glycosyl compounds Cyclohexenones Pyrans Oxanes Monosaccharides Morpholines Tertiary carboxylic acid amides Carboxylic acid esters Acetals Azacyclic compounds Oxacyclic compounds Dialkyl ethers Organopnictogen compounds Hydrocarbon derivatives Organonitrogen compounds Organic oxides
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Triterpene saponin - Triterpenoid - Pentacarboxylic acid or derivatives - 2-naphthalenecarboxamide - Glycosyl compound - O-glycosyl compound - Cyclohexenone - Monosaccharide - Morpholine - Oxane - Oxazinane - Pyran - Tertiary carboxylic acid amide - Carboxylic acid ester - Carboxamide group - Ketone - Azacycle - Organoheterocyclic compound - Oxacycle - Carboxylic acid derivative - Dialkyl ether - Ether - Acetal - Organic nitrogen compound - Organic oxide - Carbonyl group - Hydrocarbon derivative - Organic oxygen compound - Organopnictogen compound - Organonitrogen compound - 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