Compound Identification
SMILES
COC(=O)C1=CO[C@@H](O[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)[C@H]2[C@H]1[C@@H](O)C=C2COC(=O)SC
InChIKey
InChIKey=JNDNZIPLLDTLQK-KSXVZMDZSA-N
Formula
C19H26O12S
Mass
478.47
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Prenol lipids
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Subclass
Terpene glycosides
- Level 5 Iridoid O-glycosides
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Subclass
Terpene glycosides
-
Class
Prenol lipids
-
Superclass
Lipids and lipid-like molecules
Kingdom
Organic compounds
Superclass
Lipids and lipid-like molecules
Class
Prenol lipids
Subclass
Terpene glycosides
Intermediate Tree Nodes
Not available
Direct Parent
Iridoid O-glycosides
Alternative Parents
Hexoses O-glycosyl compounds Bicyclic monoterpenoids Iridoids and derivatives Oxanes Vinylogous esters Enoate esters Methyl esters Monothioacetals Secondary alcohols Organic thiocarbonic acid derivatives Acetals Sulfenyl compounds Polyols Oxacyclic compounds Monocarboxylic acids and derivatives Hydrocarbon derivatives Primary alcohols Organic oxides Carbonyl compounds
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Iridoid o-glycoside - Hexose monosaccharide - Glycosyl compound - Iridoid-skeleton - O-glycosyl compound - Bicyclic monoterpenoid - Monoterpenoid - Monosaccharide - Oxane - Vinylogous ester - Monothioacetal - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Methyl ester - Secondary alcohol - Carboxylic acid ester - Thiocarbonic acid derivative - Sulfenyl compound - Polyol - Carboxylic acid derivative - Oxacycle - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Acetal - Hydrocarbon derivative - Organic oxide - Primary alcohol - Carbonyl group - Organic oxygen compound - Organosulfur compound - Alcohol - Organooxygen compound - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as iridoid o-glycosides. These are iridoid monoterpenes containing a glycosyl (usually a pyranosyl) moiety linked to the iridoid skeleton.
External Descriptors
Not available