Compound Identification
SMILES
CC1C2C(CC3=CC=CC=C3)NC(=O)C22OC(=O)O\C=C\C(C)(O)C(=O)C(C)C\C=C\C2C2OC12C
InChIKey
InChIKey=LAJXCUNOQSHRJO-KRQHZRJMSA-N
Formula
C28H33NO7
Mass
495.572
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Alkaloids and derivatives
- Class Cytochalasans
-
Superclass
Alkaloids and derivatives
Kingdom
Organic compounds
Superclass
Alkaloids and derivatives
Class
Cytochalasans
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Cytochalasans
Alternative Parents
Macrolactams Isoindolones Oxepanes Acyloins Pyrrolidine-2-ones Benzene and substituted derivatives Carbonic acid diesters Tertiary alcohols Enol esters Secondary carboxylic acid amides Cyclic ketones Lactams Dialkyl ethers Azacyclic compounds Epoxides Oxacyclic compounds Organic oxides Organonitrogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cytoglobosin skeleton - Cytochalasan - Macrolactam - Isoindolone - Isoindoline - Isoindole or derivatives - Oxepane - Monocyclic benzene moiety - Carbonic acid diester - Benzenoid - 2-pyrrolidone - Pyrrolidone - Acyloin - Enol ester - Tertiary alcohol - Pyrrolidine - Carboxamide group - Cyclic ketone - Secondary carboxylic acid amide - Ketone - Lactam - Carbonic acid derivative - Organoheterocyclic compound - Ether - Oxirane - Azacycle - Dialkyl ether - Carboxylic acid derivative - Oxacycle - Alcohol - Organic oxygen compound - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - 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