Compound Identification
SMILES
COC1=CC(\C=C\C(=O)OCC2OC(O[C@@H]3OC=C([C@H]4C=C[C@](O)(CO)[C@@H]34)C(O)=O)C(O)C(O)C2O)=CC=C1O
InChIKey
InChIKey=KAKMKHUXDFAONC-CNAWFBIYSA-N
Formula
C26H30O14
Mass
566.512
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
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
Cinnamic acid esters Coumaric acids and derivatives O-glycosyl compounds Aromatic monoterpenoids Bicyclic monoterpenoids Iridoids and derivatives Methoxyphenols Styrenes Anisoles Phenoxy compounds Methoxybenzenes 1-hydroxy-2-unsubstituted benzenoids Alkyl aryl ethers Fatty acid esters Oxanes Dicarboxylic acids and derivatives Monosaccharides Enoate esters Vinylogous esters Tertiary alcohols Secondary alcohols Acetals Oxacyclic compounds Carboxylic acids Polyols Carbonyl compounds Primary alcohols Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Iridoid o-glycoside - Cinnamic acid ester - Hydroxycinnamic acid or derivatives - Coumaric acid or derivatives - Cinnamic acid or derivatives - O-glycosyl compound - Iridoid-skeleton - Glycosyl compound - Monoterpenoid - Methoxyphenol - Aromatic monoterpenoid - Bicyclic monoterpenoid - Anisole - Phenol ether - Styrene - Phenoxy compound - Methoxybenzene - Alkyl aryl ether - 1-hydroxy-2-unsubstituted benzenoid - Fatty acid ester - Phenol - Monocyclic benzene moiety - Fatty acyl - Dicarboxylic acid or derivatives - Benzenoid - Monosaccharide - Oxane - Tertiary alcohol - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Vinylogous ester - Secondary alcohol - Carboxylic acid ester - Polyol - Acetal - Oxacycle - Carboxylic acid derivative - Ether - Carboxylic acid - Organoheterocyclic compound - Organooxygen compound - Carbonyl group - Primary alcohol - Organic oxide - Alcohol - Hydrocarbon derivative - Organic oxygen compound - 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