Compound Identification
SMILES
CC1OC(OC2CCC3(C=O)C4CCC5(C)C(CCC5(O)C4CCC3(C2)OC(C)=O)C23OC2OC(=O)C=C3)C(O)C(O)C1O
InChIKey
InChIKey=UXPACSIPUDGOAH-UHFFFAOYSA-N
Formula
C32H44O12
Mass
620.692
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Steroids and steroid derivatives
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Subclass
Steroid lactones
- Level 5 Bufanolides and derivatives
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Subclass
Steroid lactones
-
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
Steroid lactones
Intermediate Tree Nodes
Bufanolides and derivatives
Direct Parent
Bufanolide glycosides and derivatives
Alternative Parents
Steroidal glycosides Steroid esters 19-oxosteroids 14-hydroxysteroids Hexoses O-glycosyl compounds Enol ester epoxides Dihydropyranones Dicarboxylic acids and derivatives Oxanes Enoate esters Tertiary alcohols Secondary alcohols Cyclic alcohols and derivatives Lactones Oxacyclic compounds Polyols Acetals Hydrocarbon derivatives Aldehydes Organic oxides
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Bufanolide-glycoside - Steroidal glycoside - Steroid ester - 19-oxosteroid - 14-hydroxysteroid - Hydroxysteroid - Oxosteroid - Hexose monosaccharide - Glycosyl compound - O-glycosyl compound - Enol ester epoxide - Dihydropyranone - Dicarboxylic acid or derivatives - Monosaccharide - Oxane - Pyran - Enoate ester - Tertiary alcohol - Alpha,beta-unsaturated carboxylic ester - Cyclic alcohol - Secondary alcohol - Lactone - Carboxylic acid ester - Polyol - Organoheterocyclic compound - Oxacycle - Carboxylic acid derivative - Oxirane - Acetal - Aldehyde - Organic oxide - Hydrocarbon derivative - Carbonyl group - Organic oxygen compound - Alcohol - Organooxygen compound - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as bufanolide glycosides and derivatives. These are bufanolides that are glycosidically linked to a glucose moiety.
External Descriptors
Not available