Compound Identification
SMILES
COS(=O)(=O)OC1CCC2(C)C(CCC3C2CCC2(C)C(CC4OC324)C2=COC(=O)C=C2)C1
InChIKey
InChIKey=BRABLBDNTXSWQN-UHFFFAOYSA-N
Formula
C25H34O7S
Mass
478.6
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
-
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
Sulfated steroids Naphthopyrans Naphthalenes Sulfuric acid diesters Pyranones and derivatives Oxanes Alkyl sulfates Heteroaromatic compounds Lactones Oxacyclic compounds Epoxides Dialkyl ethers Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Bufanolide-skeleton - Sulfated steroid skeleton - Naphthopyran - Naphthalene - Pyranone - Sulfuric acid diester - Oxane - Pyran - Alkyl sulfate - Sulfuric acid ester - Heteroaromatic compound - Organic sulfuric acid or derivatives - Lactone - Ether - Oxacycle - Organoheterocyclic compound - Dialkyl ether - Oxirane - Organic oxygen compound - Organooxygen compound - Hydrocarbon derivative - 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