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)C2C(CO)C(O)C(OC(=O)\C=C\C3=CC(O)=C(O)C=C3)[C@H]12
InChIKey
InChIKey=JVFPKSJJCQBJRO-ZIGVIQCPSA-N
Formula
C26H32O15
Mass
584.527
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Lipids and lipid-like molecules
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Class
Prenol lipids
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Subclass
Terpene glycosides
- Level 5 Iridoid O-glycosides
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Subclass
Terpene glycosides
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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 Coumaric acids and derivatives Cinnamic acid esters O-glycosyl compounds Iridoids and derivatives Bicyclic monoterpenoids Aromatic monoterpenoids Styrenes Catechols Fatty acid esters 1-hydroxy-4-unsubstituted benzenoids 1-hydroxy-2-unsubstituted benzenoids Oxanes Dicarboxylic acids and derivatives Vinylogous esters Methyl esters Enoate esters Secondary alcohols Cyclic alcohols and derivatives Polyols Oxacyclic compounds Acetals Primary alcohols Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Iridoid o-glycoside - Cinnamic acid ester - Hydroxycinnamic acid or derivatives - Hexose monosaccharide - Coumaric acid or derivatives - Cinnamic acid or derivatives - O-glycosyl compound - Iridoid-skeleton - Glycosyl compound - Monoterpenoid - Bicyclic monoterpenoid - Aromatic monoterpenoid - Styrene - Catechol - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Fatty acid ester - Fatty acyl - Benzenoid - Oxane - Monosaccharide - Dicarboxylic acid or derivatives - Monocyclic benzene moiety - Vinylogous ester - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Methyl ester - Cyclic alcohol - Secondary alcohol - Carboxylic acid ester - Oxacycle - Organoheterocyclic compound - Polyol - Carboxylic acid derivative - Acetal - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Primary alcohol - Organooxygen compound - Carbonyl group - Alcohol - Aromatic 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