Compound Identification
SMILES
COC1=C(OC2OC(C(O)C(O)C2O)C(O)=O)C=C2CCC3C4CCC(=O)C4(C)CCC3C2=C1
InChIKey
InChIKey=NZTHZDNDYACBSX-UHFFFAOYSA-N
Formula
C25H32O9
Mass
476.522
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Steroids and steroid derivatives
-
Subclass
Steroidal glycosides
- Level 5 Steroid glucuronide conjugates
-
Subclass
Steroidal glycosides
-
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
Steroidal glycosides
Intermediate Tree Nodes
Not available
Direct Parent
Steroid glucuronide conjugates
Alternative Parents
17-oxosteroids Estrane steroids Phenolic glycosides Fatty acyl glycosides of mono- and disaccharides Phenanthrenes and derivatives O-glucuronides Alkyl glycosides O-glycosyl compounds Tetralins Anisoles Alkyl aryl ethers Beta hydroxy acids and derivatives Pyrans Oxanes Monosaccharides Secondary alcohols Ketones Carboxylic acids Oxacyclic compounds Acetals Polyols Monocarboxylic acids and derivatives Aldehydes Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Steroid-glucuronide-skeleton - 17-oxosteroid - Estrane-skeleton - Oxosteroid - Phenolic glycoside - Fatty acyl glycoside - Fatty acyl glycoside of mono- or disaccharide - 1-o-glucuronide - O-glucuronide - Phenanthrene - Glucuronic acid or derivatives - Alkyl glycoside - O-glycosyl compound - Glycosyl compound - Tetralin - Anisole - Beta-hydroxy acid - Alkyl aryl ether - Oxane - Pyran - Benzenoid - Monosaccharide - Fatty acyl - Hydroxy acid - Secondary alcohol - Ketone - Polyol - Acetal - Ether - Organoheterocyclic compound - Carboxylic acid - Carboxylic acid derivative - Oxacycle - Monocarboxylic acid or derivatives - Organooxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Aldehyde - Alcohol - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as steroid glucuronide conjugates. These are sterol lipids containing a glucuronide moiety linked to the steroid skeleton.
External Descriptors
Not available