Compound Identification
SMILES
CC12CCC3C(CCC4CC(O)CCC34C)C1C(=O)CC2C1=COC(=O)C=C1
InChIKey
InChIKey=NTLOERPHSXBROY-UHFFFAOYSA-N
Formula
C24H32O4
Mass
384.516
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Steroids and steroid derivatives
-
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
Not available
Direct Parent
Bufanolides and derivatives
Alternative Parents
Oxosteroids 3-hydroxysteroids Pyranones and derivatives Heteroaromatic compounds Secondary alcohols Lactones Ketones Cyclic alcohols and derivatives Oxacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Bufanolide-skeleton - 3-hydroxysteroid - Hydroxysteroid - 15-oxosteroid - Oxosteroid - Pyranone - Pyran - Cyclic alcohol - Heteroaromatic compound - Lactone - Ketone - Secondary alcohol - Oxacycle - Organoheterocyclic compound - Alcohol - Organooxygen compound - Hydrocarbon derivative - Organic oxygen compound - Carbonyl group - Organic oxide - 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