Structure Information
Structure

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]1C[C@@H](O)[C@H]2[C@H]1NCCC2=C1NC1=CC=CC=C21

InChIKey

InChIKey=OCAHJZIVWQCZJJ-FQRZEKASSA-N

Formula

C27H34N2O10

Mass

546.573

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Taxonomic Classification

Taxonomy Tree

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

Harmala alkaloids Beta carbolines Hexoses O-glycosyl compounds Aromatic monoterpenoids 3-alkylindoles Iridoids and derivatives Aralkylamines Benzenoids Oxanes Pyrroles Methyl esters Vinylogous esters Enoate esters Heteroaromatic compounds Amino acids and derivatives Cyclic alcohols and derivatives Secondary alcohols Dialkylamines Oxacyclic compounds Monocarboxylic acids and derivatives Azacyclic compounds Polyols Acetals Organopnictogen compounds Carbonyl compounds Primary alcohols Hydrocarbon derivatives Organic oxides

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Iridoid o-glycoside - Harman - Beta-carboline - Pyridoindole - Hexose monosaccharide - Glycosyl compound - Iridoid-skeleton - O-glycosyl compound - Aromatic monoterpenoid - Monoterpenoid - 3-alkylindole - Indole - Indole or derivatives - Alkaloid or derivatives - Aralkylamine - Monosaccharide - Oxane - Benzenoid - Cyclic alcohol - Pyrrole - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Methyl ester - Heteroaromatic compound - Vinylogous ester - Secondary alcohol - Carboxylic acid ester - Amino acid or derivatives - Organoheterocyclic compound - Acetal - Monocarboxylic acid or derivatives - Azacycle - Oxacycle - Carboxylic acid derivative - Polyol - Secondary amine - Secondary aliphatic amine - Amine - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Alcohol - Primary 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

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