Structure Information
Structure

Compound Identification

SMILES

COCO[C@H]1CC[C@]2(C)[C@H]3CCC(=C)[C@@H]4[C@@H]3[C@@H](OC(C)(C)O[C@H]4CC#N)C=C2C1

InChIKey

InChIKey=DEXMZLLXOBGVSG-AGWLBUSHSA-N

Formula

C24H35NO4

Mass

401.547

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Dioxepanes

Subclass

1,3-dioxepanes

Intermediate Tree Nodes

Not available

Direct Parent

1,3-dioxepanes

Alternative Parents

Ketals Oxacyclic compounds Nitriles Organopnictogen compounds Hydrocarbon derivatives

Molecular Framework

Aliphatic heteropolycyclic compounds

Substituents

Ketal - 1,3-dioxepane - Oxacycle - Nitrile - Carbonitrile - Acetal - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Cyanide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Aliphatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 1,3-dioxepanes. These are dioxepanes with the two ring oxygen atoms at position 1 and 3, respectively.

External Descriptors

Not available

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