Compound Identification
SMILES
CC(C)C[C@H]1[C@@H]2[C@H](C)C(C)=C[C@@H]3\C=C(C)/CC[C@@H]4OC(C)(C)O[C@H]4CCC(=O)[C@@]23C(=O)N1C(=O)C1=CC=CC=C1
InChIKey
InChIKey=GOGHPEXCMLQUNT-AHUGUOMTSA-N
Formula
C34H45NO5
Mass
547.736
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Alkaloids and derivatives
-
Class
Cytochalasans
- Subclass Aspochalasins
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Class
Cytochalasans
-
Superclass
Alkaloids and derivatives
Kingdom
Organic compounds
Superclass
Alkaloids and derivatives
Class
Cytochalasans
Subclass
Aspochalasins
Intermediate Tree Nodes
Not available
Direct Parent
Aspochalasins
Alternative Parents
Isoindolones Benzoic acids and derivatives Benzoyl derivatives N-acylpyrrolidines Ketals Pyrrolidine-2-ones N-substituted carboxylic acid imides 1,3-dioxolanes Dicarboximides Lactams Ketones Azacyclic compounds Oxacyclic compounds Hydrocarbon derivatives Organic oxides Organonitrogen compounds Organopnictogen compounds Aldehydes
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Aspochalasin skeleton - Isoindolone - Benzoic acid or derivatives - Isoindole or derivatives - Isoindoline - N-acylpyrrolidine - Benzoyl - Ketal - Carboxylic acid imide, n-substituted - Monocyclic benzene moiety - Pyrrolidone - 2-pyrrolidone - Benzenoid - Carboxylic acid imide - Pyrrolidine - Meta-dioxolane - Dicarboximide - Ketone - Lactam - Acetal - Carboxylic acid derivative - Oxacycle - Azacycle - Organoheterocyclic compound - Hydrocarbon derivative - Organic nitrogen compound - Carbonyl group - Organic oxide - Organopnictogen compound - Aldehyde - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Aromatic 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