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Structure Information
Structure

Compound Identification

SMILES

C[C@H]1[C@H]2[C@H](CC3=CC=CC=C3)NC(=O)[C@@]22[C@@H](\C=C\C[C@H](C)C[C@@](C)(O)\C=C\[C@H]2O)[C@@H]2O[C@]12C

InChIKey

InChIKey=COONBRMXQBPXKF-RWGJCPSUSA-N

Formula

C28H37NO4

Mass

451.607

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Alkaloids and derivatives

Class

Cytochalasans

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Cytochalasans

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Carbocyclic cytochalasan skeleton - Cytochalasan - Isoindolone - Isoindoline - Isoindole or derivatives - Oxepane - Monocyclic benzene moiety - Benzenoid - 2-pyrrolidone - Pyrrolidone - Tertiary alcohol - Pyrrolidine - Carboxamide group - Secondary carboxylic acid amide - Secondary alcohol - Lactam - Carboxylic acid derivative - Dialkyl ether - Oxirane - Ether - Oxacycle - Azacycle - Organoheterocyclic compound - Hydrocarbon derivative - Organic nitrogen compound - Carbonyl group - Organic oxygen compound - Alcohol - Organic oxide - Organooxygen compound - Organonitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as cytochalasans. These are fungal metabolites structurally characterized by the presence of an isoindolone nucleus fused to a macrocyclic ring, which can either a lactone, as in cytochalasin B, a carbonate, as in cytochalasin E, or a carbocycle, as in cytochalasin D, H, and K.

External Descriptors

Not available

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