Compound Identification
SMILES
CC12CCC3C(CCC4=CC(=O)CCC34C)C1CCC2OC1OC(C(O)C(O)C1O)C([O-])=O
InChIKey
InChIKey=NIKZPECGCSUSBV-UHFFFAOYSA-M
Formula
C25H35O8
Mass
463.548
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Steroids and steroid derivatives
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Subclass
Steroidal glycosides
- Level 5 Steroid glucuronide conjugates
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Subclass
Steroidal glycosides
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Class
Steroids and steroid derivatives
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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
Androgens and derivatives 3-oxo delta-4-steroids Delta-4-steroids O-glucuronides Hexoses O-glycosyl compounds Beta hydroxy acids and derivatives Cyclohexenones Pyrans Oxanes Secondary alcohols Carboxylic acid salts Oxacyclic compounds Polyols Acetals Monocarboxylic acids and derivatives Carboxylic acids Organic oxides Hydrocarbon derivatives Aldehydes Organic anions
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Steroid-glucuronide-skeleton - Androgen-skeleton - Androstane-skeleton - 3-oxo-delta-4-steroid - 3-oxosteroid - Oxosteroid - Delta-4-steroid - 1-o-glucuronide - O-glucuronide - Glucuronic acid or derivatives - Hexose monosaccharide - O-glycosyl compound - Glycosyl compound - Beta-hydroxy acid - Cyclohexenone - Pyran - Oxane - Hydroxy acid - Monosaccharide - Secondary alcohol - Ketone - Carboxylic acid salt - Cyclic ketone - Acetal - Oxacycle - Organoheterocyclic compound - Carboxylic acid derivative - Carboxylic acid - Polyol - Monocarboxylic acid or derivatives - Organic oxygen compound - Organic oxide - Carbonyl group - Alcohol - Aldehyde - Organooxygen compound - Hydrocarbon derivative - 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