Compound Identification
SMILES
COC1=CC=C(CC2NC(=O)C34OC(=O)OCCC(C)(O)C(=O)C(C)C\C=C\C3C3OC3(C)C(C)C24)C=C1
InChIKey
InChIKey=STPONZNLANXPID-SOFGYWHQSA-N
Formula
C29H37NO8
Mass
527.614
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 Phenoxy compounds Anisoles Methoxybenzenes Oxepanes Alkyl aryl ethers Acyloins Pyrrolidine-2-ones Carbonic acid diesters Tertiary alcohols Secondary carboxylic acid amides Cyclic ketones Lactams Dialkyl ethers Oxacyclic compounds Azacyclic compounds Epoxides Organic oxides Hydrocarbon derivatives Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cytoglobosin skeleton - Cytochalasan - Macrolactam - Isoindolone - Isoindoline - Isoindole or derivatives - Phenoxy compound - Anisole - Methoxybenzene - Phenol ether - Alkyl aryl ether - Oxepane - Acyloin - Monocyclic benzene moiety - 2-pyrrolidone - Pyrrolidone - Benzenoid - Carbonic acid diester - Pyrrolidine - Tertiary alcohol - Carboxamide group - Cyclic ketone - Secondary carboxylic acid amide - Ketone - Lactam - Carbonic acid derivative - Ether - Oxirane - Dialkyl ether - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Oxacycle - Alcohol - Organic nitrogen compound - Carbonyl group - Organic oxygen compound - Organooxygen compound - Organic oxide - Organonitrogen compound - Hydrocarbon derivative - 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