Compound Identification
SMILES
CC(=O)C1CCC2C3CC=C4CC(CCC4(C)C3CCC12C)OC1OC(C(O)C(O)C1O)C([O-])=O
InChIKey
InChIKey=OIXRDYLASYTIRO-UHFFFAOYSA-M
Formula
C27H39O8
Mass
491.602
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
Pregnane steroids 20-oxosteroids Delta-5-steroids O-glucuronides Hexoses O-glycosyl compounds Beta hydroxy acids and derivatives Pyrans Oxanes Secondary alcohols Carboxylic acid salts Ketones Polyols Acetals Oxacyclic compounds Carboxylic acids Monocarboxylic acids and derivatives Aldehydes Organic oxides Hydrocarbon derivatives Organic anions
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Steroid-glucuronide-skeleton - Pregnane-skeleton - 20-oxosteroid - Oxosteroid - Delta-5-steroid - 1-o-glucuronide - O-glucuronide - Glucuronic acid or derivatives - Hexose monosaccharide - Glycosyl compound - O-glycosyl compound - Beta-hydroxy acid - Hydroxy acid - Monosaccharide - Pyran - Oxane - Secondary alcohol - Ketone - Carboxylic acid salt - Polyol - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Acetal - Organoheterocyclic compound - Oxacycle - Carboxylic acid - Organooxygen compound - Aldehyde - Organic oxide - Hydrocarbon derivative - Alcohol - Carbonyl group - Organic oxygen 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