Compound Identification
SMILES
CC(=O)C1CCC2C3CCC4CC(CCC4(C)C3CCC12C)OC1OC(C(O)C(O)C1O)C([O-])=O
InChIKey
InChIKey=MTPPQBWTGIHMPB-UHFFFAOYSA-M
Formula
C27H41O8
Mass
493.618
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
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Subclass
Steroidal glycosides
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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
Steroidal glycosides
Intermediate Tree Nodes
Not available
Direct Parent
Steroid glucuronide conjugates
Alternative Parents
20-oxosteroids Pregnane steroids O-glucuronides Hexoses O-glycosyl compounds Beta hydroxy acids and derivatives Pyrans Oxanes Ketones Carboxylic acid salts Secondary alcohols Oxacyclic compounds Acetals Monocarboxylic acids and derivatives Polyols Carboxylic acids Hydrocarbon derivatives Aldehydes Organic oxides Organic anions
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Steroid-glucuronide-skeleton - Pregnane-skeleton - 20-oxosteroid - Oxosteroid - 1-o-glucuronide - O-glucuronide - Glucuronic acid or derivatives - Hexose monosaccharide - Glycosyl compound - O-glycosyl compound - Beta-hydroxy acid - Hydroxy acid - Monosaccharide - Pyran - Oxane - Carboxylic acid salt - Ketone - Secondary alcohol - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Oxacycle - Carboxylic acid - Acetal - Carboxylic acid derivative - Polyol - Alcohol - Hydrocarbon derivative - Organic oxide - Carbonyl group - Organic oxygen compound - Aldehyde - Organooxygen compound - Organic anion - Aliphatic 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