Compound Identification
SMILES
C[C@]12CC[C@H]3[C@@H](CCC4=C3C=CC(O[C@@H]3O[C@@H]([C@@H](O)[C@H](O)[C@H]3O)C(O)=O)=C4)[C@@H]1CC[C@@H]2O
InChIKey
InChIKey=MUOHJTRCBBDUOW-QXYWQCSFSA-N
Formula
C24H32O8
Mass
448.512
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Lipids and lipid-like molecules
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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
17-hydroxysteroids Estrane steroids Phenolic glycosides Fatty acyl glycosides of mono- and disaccharides Phenanthrenes and derivatives O-glucuronides Alkyl glycosides O-glycosyl compounds Tetralins Beta hydroxy acids and derivatives Pyrans Oxanes Monosaccharides Cyclic alcohols and derivatives Secondary alcohols Oxacyclic compounds Acetals Carboxylic acids Polyols Monocarboxylic acids and derivatives Hydrocarbon derivatives Carbonyl compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Steroid-glucuronide-skeleton - Estrane-skeleton - Hydroxysteroid - 17-hydroxysteroid - Fatty acyl glycoside - Phenolic 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 - Beta-hydroxy acid - Fatty acyl - Pyran - Benzenoid - Oxane - Monosaccharide - Hydroxy acid - Cyclic alcohol - Secondary alcohol - Polyol - Organoheterocyclic compound - Carboxylic acid derivative - Carboxylic acid - Acetal - Monocarboxylic acid or derivatives - Oxacycle - Alcohol - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Carbonyl group - Organooxygen compound - 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
CHEBI:36489 :
steroid glucosiduronic acid
LIPIDMAPS (LMST05010007) :
Glucuronides
KEGG (C05503) :
C18 steroids (estrogens) and derivatives - Glucuronides