Compound Identification
SMILES
CC(C)C(=O)CCC(C)[C@H]1[C@@H](O)C[C@@]2(C)[C@@H]3CCC4[C@]5(C[C@@]35[C@H](O)C[C@]12C)CC[C@H](OC1OC(CO)C(O)C(OC2OC(CO)C(O)C(O)C2O)C1OC1OC(CO)C(O)C(O)C1O)C4(C)C
InChIKey
InChIKey=KNZYUMQJLPENNS-KBAUXIBBSA-N
Formula
C48H80O19
Mass
961.149
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
Steroids and steroid derivatives
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Subclass
Steroidal glycosides
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Level 5
Steroidal saponins
- Level 6 Cucurbitacin glycosides
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Level 5
Steroidal saponins
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Subclass
Steroidal glycosides
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Class
Steroids and steroid derivatives
-
Superclass
Lipids and lipid-like molecules
Kingdom
Organic compounds
Superclass
Lipids and lipid-like molecules
Class
Steroids and steroid derivatives
Subclass
Steroidal glycosides
Intermediate Tree Nodes
Steroidal saponins
Direct Parent
Cucurbitacin glycosides
Alternative Parents
Triterpene saponins Vitamin D and derivatives Triterpenoids Cycloartanols and derivatives Dihydroxy bile acids, alcohols and derivatives Oxosteroids 16-beta-hydroxysteroids 11-alpha-hydroxysteroids Fatty acyl glycosides of mono- and disaccharides Alkyl glycosides Oxanes Monosaccharides Secondary alcohols Ketones Cyclic alcohols and derivatives Oxacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Cucurbitacin glycoside skeleton - Triterpene saponin - Triterpene glycoside - Cycloartanol-skeleton - Triterpenoid - Cycloartane-skeleton - 9b,19-cyclo-lanostane-skeleton - 24-oxosteroid - Dihydroxy bile acid, alcohol, or derivatives - Hydroxy bile acid, alcohol, or derivatives - Bile acid, alcohol, or derivatives - 16-hydroxysteroid - 11-hydroxysteroid - 16-beta-hydroxysteroid - 11-alpha-hydroxysteroid - Oxosteroid - Hydroxysteroid - Fatty acyl glycoside of mono- or disaccharide - Fatty acyl glycoside - Alkyl glycoside - Fatty acyl - Oxane - Monosaccharide - Cyclic alcohol - Secondary alcohol - Ketone - Oxacycle - Organoheterocyclic compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Alcohol - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as cucurbitacin glycosides. These are polycyclic compounds containing a carbohydrate derivative glycosidically linked to a curcubitane nucleus.
External Descriptors
Not available