Structure Information
Structure

Compound Identification

SMILES

C[C@H]1[C@H]2[C@H](CC3=CC=C(O)C=C3)NC(=O)[C@@]22[C@@H](\C=C\C[C@H](CO)C[C@H](C)\C=C\[C@H]2OC(C)=O)[C@H](O)C1=C

InChIKey

InChIKey=JDBLMXRWROHNEX-LLXXQQOXSA-N

Formula

C30H39NO6

Mass

509.643

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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 - Isoindole or derivatives - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Monocyclic benzene moiety - Pyrrolidone - 2-pyrrolidone - Benzenoid - Pyrrolidine - Cyclic alcohol - Secondary carboxylic acid amide - Secondary alcohol - Carboxamide group - Lactam - Carboxylic acid ester - Organoheterocyclic compound - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Azacycle - Carbonyl group - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Alcohol - Primary alcohol - 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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