Compound Identification
SMILES
C[C@H](O)[C@H](O)[C@@H](O)[C@@H](O)C(=O)O[C@H]1CC[C@]2(C(CC[C@@H]3[C@@H]2CC[C@]2(C)[C@H](CC[C@]32C)C2=COC(=O)C=C2)C1)C(O)=O
InChIKey
InChIKey=FELWSQGBNNEYAT-CCZMTJRESA-N
Formula
C31H44O10
Mass
576.683
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
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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
Not available
Direct Parent
Bufanolides and derivatives
Alternative Parents
Steroid esters 19-oxosteroids Hydroxysteroids Pyranones and derivatives Fatty acid esters Beta hydroxy acids and derivatives Monosaccharides Dicarboxylic acids and derivatives Heteroaromatic compounds Secondary alcohols 1,2-diols Lactones Carboxylic acid esters Oxacyclic compounds Carboxylic acids Carbonyl compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Bufanolide-skeleton - Steroid ester - 19-hydroxysteroid - 19-oxosteroid - Hydroxysteroid - Oxosteroid - Beta-hydroxy acid - Fatty acid ester - Pyranone - Dicarboxylic acid or derivatives - Hydroxy acid - Monosaccharide - Fatty acyl - Pyran - Heteroaromatic compound - Secondary alcohol - Carboxylic acid ester - Lactone - 1,2-diol - Organoheterocyclic compound - Polyol - Carboxylic acid derivative - Carboxylic acid - Oxacycle - Organooxygen compound - Carbonyl group - Organic oxide - Organic oxygen compound - Hydrocarbon derivative - Alcohol - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as bufanolides and derivatives. These are steroid lactones containing a pyran-2-one moiety linked to the C17 atom of a cyclopenta[a]phenanthrene derivative.
External Descriptors
Not available