Compound Identification
SMILES
CC1NC(=O)C23C1C(C)=C(C)C(O)C2C=CCC(C)C1OC1(C)C(O)CC3=O
InChIKey
InChIKey=YXPDKMSUYDWDKY-UHFFFAOYSA-N
Formula
C22H31NO5
Mass
389.492
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Alkaloids and derivatives
-
Class
Cytochalasans
- Subclass Alachalasins
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Class
Cytochalasans
-
Superclass
Alkaloids and derivatives
Kingdom
Organic compounds
Superclass
Alkaloids and derivatives
Class
Cytochalasans
Subclass
Alachalasins
Intermediate Tree Nodes
Not available
Direct Parent
Alachalasins
Alternative Parents
Isoindolones Pyrrolidine-2-ones Secondary carboxylic acid amides Secondary alcohols Lactams Ketones Oxacyclic compounds Epoxides Dialkyl ethers Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Carbocyclic alachalasin skeleton - Isoindolone - Isoindoline - Isoindole or derivatives - Pyrrolidone - 2-pyrrolidone - Pyrrolidine - Carboxamide group - Ketone - Lactam - Secondary carboxylic acid amide - Secondary alcohol - Carboxylic acid derivative - Dialkyl ether - Oxirane - Ether - Oxacycle - Azacycle - Organoheterocyclic compound - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Alcohol - Organonitrogen compound - Organooxygen compound - Carbonyl group - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as alachalasins. These are cytochalasans with a structure in which the hydrogenated isoindole bears a methyl group.
External Descriptors
Not available