Compound Identification
SMILES
CC(C)[C@@H](C)[C@H](O)[C@@H]1O[C@H]2CC3[C@@H]4C[C@H](OS(O)(=O)=O)C5C[C@H](CC[C@]5(C)C4=CC[C@]3(C)[C@H]2[C@@]1(C)O)O[C@@H]1O[C@@H]([C@@H](O)[C@H](O)[C@H]1O)C(O)=O
InChIKey
InChIKey=KXALCRNKALGBET-KNUQHXJHSA-N
Formula
C34H54O14S
Mass
718.85
Taxonomic Classification
Taxonomy Tree
-
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
Diterpene glycosides Hydroxysteroids Diterpenoids Sulfated steroids O-glucuronides O-glycosyl compounds Beta hydroxy acids and derivatives Pyrans Oxanes Alkyl sulfates Monosaccharides Sulfuric acid monoesters Oxolanes Tertiary alcohols Secondary alcohols Monocarboxylic acids and derivatives Acetals Dialkyl ethers Carboxylic acids Oxacyclic compounds Polyols Hydrocarbon derivatives Carbonyl compounds Organic oxides
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Diterpene glycoside - Steroid-glucuronide-skeleton - 23-hydroxysteroid - Sulfated steroid skeleton - 20-hydroxysteroid - Diterpenoid - Hydroxysteroid - Terpene glycoside - 1-o-glucuronide - O-glucuronide - Glucuronic acid or derivatives - Glycosyl compound - O-glycosyl compound - Beta-hydroxy acid - Hydroxy acid - Sulfuric acid ester - Alkyl sulfate - Monosaccharide - Sulfate-ester - Sulfuric acid monoester - Oxane - Pyran - Oxolane - Organic sulfuric acid or derivatives - Tertiary alcohol - Secondary alcohol - Dialkyl ether - Polyol - Carboxylic acid - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Ether - Oxacycle - Acetal - Organoheterocyclic compound - Hydrocarbon derivative - Organic oxygen compound - Carbonyl group - Organooxygen compound - Organic oxide - Alcohol - 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