Compound Identification
SMILES
COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](COC(=O)C(\C)=C\CC[C@](C)(O)C=C)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@@H](C)[C@@H](O)C[C@H]12
InChIKey
InChIKey=KXJAPGVKHIYNOZ-BNOWPKJYSA-N
Formula
C27H40O12
Mass
556.605
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Prenol lipids
-
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
Saccharolipids O-glycosyl compounds Bicyclic monoterpenoids Iridoids and derivatives Fatty acid esters Dicarboxylic acids and derivatives Oxanes Monosaccharides Vinylogous esters Tertiary alcohols Enoate esters Methyl esters Secondary alcohols Cyclic alcohols and derivatives Acetals Polyols Oxacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Iridoid o-glycoside - Saccharolipid - Glycosyl compound - Iridoid-skeleton - O-glycosyl compound - Bicyclic monoterpenoid - Monoterpenoid - Fatty acid ester - Dicarboxylic acid or derivatives - Monosaccharide - Fatty acyl - Oxane - Tertiary alcohol - Vinylogous ester - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Methyl ester - Cyclic alcohol - Secondary alcohol - Carboxylic acid ester - Polyol - Organoheterocyclic compound - Oxacycle - Carboxylic acid derivative - Acetal - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Carbonyl group - 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