Structure Information
Structure

Compound Identification

SMILES

CC(C)OC1=NC=C(C=C1C1=C[C@@]2(CC[C@H](CNC(C)(C)CF)[C@H]2C2=CC=C(F)C=C2)OC1)C(F)(F)F

InChIKey

InChIKey=QHYNIUXSVAHQEE-RMQVNJIYSA-N

Formula

C28H33F5N2O2

Mass

524.576

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Prenol lipids

Subclass

Monoterpenoids

Intermediate Tree Nodes

Not available

Direct Parent

Iridoids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Aromatic monoterpenoid - 11-noriridane monoterpenoid - Alkyl aryl ether - Fluorobenzene - Halobenzene - Aralkylamine - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Pyridine - Benzenoid - Dihydrofuran - Heteroaromatic compound - Azacycle - Organoheterocyclic compound - Secondary amine - Dialkyl ether - Secondary aliphatic amine - Ether - Oxacycle - Amine - Alkyl halide - Alkyl fluoride - Organooxygen compound - Organic oxygen compound - Hydrocarbon derivative - Organonitrogen compound - Organic nitrogen compound - Organohalogen compound - Organofluoride - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as iridoids and derivatives. These are monoterpenes containing a skeleton structurally characterized by the presence of a cylopentane fused to a pyran ( forming a 4,7-dimethylcyclopenta[c]pyran), or a derivative where the pentane moiety is open.

External Descriptors

Not available

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