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Structure Information
Structure

Compound Identification

SMILES

CC(C)C[C@@H]1NC(=O)[C@]23[C@H]1[C@H](C)C(C)=C[C@@H]2\C=C(C)/CC[C@@H]1OC(C)(C)O[C@H]1CCC3=O

InChIKey

InChIKey=LSWAGZSQKSSVQE-IKABYMROSA-N

Formula

C27H41NO4

Mass

443.628

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Alkaloids and derivatives

Class

Cytochalasans

Subclass

Aspochalasins

Intermediate Tree Nodes

Not available

Direct Parent

Aspochalasins

Alternative Parents

Molecular Framework

Aliphatic heteropolycyclic compounds

Substituents

Aspochalasin skeleton - Isoindolone - Isoindoline - Isoindole or derivatives - Ketal - 2-pyrrolidone - Pyrrolidone - Meta-dioxolane - Pyrrolidine - Carboxamide group - Ketone - Lactam - Secondary carboxylic acid amide - Acetal - Carboxylic acid derivative - Oxacycle - Azacycle - Organoheterocyclic compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic nitrogen compound - Organic oxygen compound - Aldehyde - Carbonyl group - Organonitrogen compound - Organooxygen compound - Aliphatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as aspochalasins. These are cytochalasans with a structure in which the hydrogenated isoindole bears a 2-methylpropyl group.

External Descriptors

Not available

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