Compound Identification
SMILES
CC1CC(OC(C)=O)C(O)C(OC2CCC3(C=O)C4C(O)C(=O)C5(C)C(CCC5(O)C4CCC3(O)C2)C2=COC(=O)CC2)O1
InChIKey
InChIKey=LCGMTGYOCYCLFV-UHFFFAOYSA-N
Formula
C32H44O12
Mass
620.692
Taxonomic Classification
Taxonomy Tree
-
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
Steroid lactones
- Level 5 Bufanolides and derivatives
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Subclass
Steroid lactones
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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
Steroid lactones
Intermediate Tree Nodes
Bufanolides and derivatives
Direct Parent
Bufanolide glycosides and derivatives
Alternative Parents
Steroidal glycosides 19-oxosteroids 11-hydroxysteroids 14-hydroxysteroids Dihydropyranones Oxanes Dicarboxylic acids and derivatives Tertiary alcohols Enol esters Secondary alcohols Lactones Ketones Cyclic alcohols and derivatives Polyols Oxacyclic compounds Acetals Aldehydes Hydrocarbon derivatives Organic oxides
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Bufanolide-glycoside - Steroidal glycoside - 19-oxosteroid - 14-hydroxysteroid - 5-hydroxysteroid - 11-hydroxysteroid - Hydroxysteroid - 12-oxosteroid - Oxosteroid - Dihydropyranone - Dicarboxylic acid or derivatives - Oxane - Cyclic alcohol - Enol ester - Tertiary alcohol - Lactone - Ketone - Secondary alcohol - Carboxylic acid ester - Polyol - Carboxylic acid derivative - Organoheterocyclic compound - Acetal - Oxacycle - Organooxygen compound - Aldehyde - Carbonyl group - Organic oxide - Hydrocarbon derivative - Alcohol - Organic oxygen 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