Structure Information
Structure

Compound Identification

SMILES

CCOC1=CC2=CC[C@H]3[C@@H]4C[C@H](C)[C@](CCC(O)=O)(C(=O)CCl)[C@@]4(C)C[C@@H]4O[C@]34[C@@]2(C)CC1O

InChIKey

InChIKey=UUWLECRZBTYDGS-WEVBSCEZSA-N

Formula

C27H37ClO6

Mass

493.04

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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

Aliphatic heteropolycyclic compounds

Substituents

11-noriridane monoterpenoid - Medium-chain fatty acid - Halogenated fatty acid - Heterocyclic fatty acid - Hydroxy fatty acid - Oxepane - Fatty acyl - Alpha-haloketone - Alpha-chloroketone - Ketone - Secondary alcohol - Organoheterocyclic compound - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Dialkyl ether - Oxacycle - Oxirane - Ether - Aldehyde - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Alcohol - Organohalogen compound - Organochloride - Carbonyl group - Alkyl halide - Alkyl chloride - Organooxygen compound - Aliphatic 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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