Compound Identification
SMILES
CC(C)C[C@@H]1NC(=O)[C@]23[C@H]1[C@H](C)C(C)=C[C@@H]2\C=C(C)\CC[C@@H](O)[C@@H](O)[C@@H]1O[C@@H]1C3=O
InChIKey
InChIKey=MJNAZPNWAXZOTC-ZLMPOGBNSA-N
Formula
C24H35NO5
Mass
417.546
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 Pyrrolidine-2-ones Secondary carboxylic acid amides Secondary alcohols Lactams Ketones 1,2-diols Oxacyclic compounds Epoxides Dialkyl ethers Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Aspochalasin skeleton - Isoindolone - Isoindoline - Isoindole or derivatives - Pyrrolidone - 2-pyrrolidone - Pyrrolidine - 1,2-diol - Carboxamide group - Ketone - Lactam - Secondary alcohol - Secondary carboxylic acid amide - Ether - Oxirane - Dialkyl ether - Oxacycle - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Organonitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Alcohol - Aliphatic 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