Compound Identification
SMILES
CSC(=O)CC(=O)OC(CC1(C)OC1(C)C)C(C)C1CCC2C3C(O)CC4=CC(=O)CC(OC(C)=O)C4(C)C3CCC12C
InChIKey
InChIKey=OHEDEHGBHXSULQ-UHFFFAOYSA-N
Formula
C34H50O8S
Mass
618.83
Taxonomic Classification
Taxonomy Tree
- Kingdom Organic compounds
Kingdom
Organic compounds
Superclass
Lipids and lipid-like molecules
Class
Steroids and steroid derivatives
Subclass
Bile acids, alcohols and derivatives
Intermediate Tree Nodes
Hydroxy bile acids, alcohols and derivatives
Direct Parent
Monohydroxy bile acids, alcohols and derivatives
Alternative Parents
Cholesterols and derivatives Steroid esters 3-oxo delta-4-steroids 7-hydroxysteroids Delta-4-steroids Cyclohexenones 1,3-dicarbonyl compounds Dicarboxylic acids and derivatives Thioesters Secondary alcohols Carbothioic S-esters Carboxylic acid esters Cyclic alcohols and derivatives Sulfenyl compounds Oxacyclic compounds Dialkyl ethers Epoxides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Cholesterol-skeleton - Cholestane-skeleton - Monohydroxy bile acid, alcohol, or derivatives - Steroid ester - 3-oxo-delta-4-steroid - 3-oxosteroid - Hydroxysteroid - 7-hydroxysteroid - Oxosteroid - Delta-4-steroid - Cyclohexenone - Dicarboxylic acid or derivatives - 1,3-dicarbonyl compound - Cyclic alcohol - Carboxylic acid ester - Carbothioic s-ester - Cyclic ketone - Ketone - Thiocarboxylic acid ester - Secondary alcohol - Ether - Oxirane - Dialkyl ether - Organoheterocyclic compound - Oxacycle - Sulfenyl compound - Carboxylic acid derivative - Thiocarboxylic acid or derivatives - Alcohol - Organic oxide - Hydrocarbon derivative - Organic oxygen compound - Organooxygen compound - Organosulfur compound - Carbonyl group - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as monohydroxy bile acids, alcohols and derivatives. These are bile acids, alcohols or any of their derivatives bearing a hydroxyl group.
External Descriptors
Not available