Compound Identification
SMILES
C[C@H]1[C@H]2[C@@H](OC11OC(=O)[C@H](C)C[C@H]1O)[C@H](O)[C@H]1[C@@H]3CC=C4C[C@H](CC[C@]4(C)[C@H]3CC[C@]21C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O[C@@H]1O[C@@H](C)[C@H](O)[C@@H](O)[C@H]1O
InChIKey
InChIKey=HOMLVLVMIWTMDJ-OAKOKLGFSA-N
Formula
C39H60O15
Mass
768.894
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
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Class
Steroids and steroid derivatives
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Subclass
Steroidal glycosides
- Level 5 Steroidal saponins
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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
Steroidal saponins
Alternative Parents
Withanolide glycosides and derivatives Triterpenoids Spirostanes and derivatives Prostaglandins and related compounds Hydroxysteroids Delta-5-steroids Disaccharides O-glycosyl compounds Ketals Delta valerolactones Oxanes Tetrahydrofurans Carboxylic acid esters Secondary alcohols Cyclic alcohols and derivatives Oxacyclic compounds Monocarboxylic acids and derivatives Polyols Organic oxides Hydrocarbon derivatives Carbonyl compounds Primary alcohols
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Steroidal saponin - Withanolide-glycoside - Triterpenoid - Spirostane skeleton - Withanolide-skeleton - Prostaglandin skeleton - 23-hydroxysteroid - Steroid lactone - Eicosanoid - 15-hydroxysteroid - Hydroxysteroid - Delta-5-steroid - Disaccharide - O-glycosyl compound - Glycosyl compound - Ketal - Delta valerolactone - Delta_valerolactone - Oxane - Fatty acyl - Cyclic alcohol - Tetrahydrofuran - Lactone - Secondary alcohol - Carboxylic acid ester - Polyol - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organoheterocyclic compound - Oxacycle - Acetal - Organooxygen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Alcohol - Carbonyl group - Primary alcohol - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as steroidal saponins. These are saponins in which the aglycone moiety is a steroid. The steroidal aglycone is usually a spirostane, furostane, spirosolane, solanidane, or curcubitacin derivative.
External Descriptors
Not available