Compound Identification
SMILES
CO[C@](C(=O)O[C@@H]1[C@H]2[C@@H]([C@H]3C=C(C)[C@@H](C)[C@H]4[C@H](CC(C)C)NC(=O)[C@@]34C1=O)[C@]1(C)CC[C@@H](O1)C2=O)(C1=CC=CC=C1)C(F)(F)F
InChIKey
InChIKey=WRSBCFYJZFBVAN-ZWDCBWDMSA-N
Formula
C34H40F3NO7
Mass
631.689
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
Naphthopyrans Azaspirodecane derivatives Naphthalenes Isoindolones Benzylethers Alpha-acyloxy ketones Pyrrolidine-2-ones Pyrans Oxanes Oxolanes Secondary carboxylic acid amides Carboxylic acid esters Lactams Ketones Oxacyclic compounds Azacyclic compounds Dialkyl ethers Monocarboxylic acids and derivatives Organofluorides Organic oxides Alkyl fluorides Hydrocarbon derivatives Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Aspochalasin skeleton - Naphthopyran - Azaspirodecane - Isoindolone - Naphthalene - Benzylether - Isoindoline - Isoindole or derivatives - Alpha-acyloxy ketone - Monocyclic benzene moiety - Benzenoid - 2-pyrrolidone - Pyrrolidone - Pyran - Oxane - Pyrrolidine - Oxolane - Carboxamide group - Carboxylic acid ester - Secondary carboxylic acid amide - Ketone - Lactam - Oxacycle - Carboxylic acid derivative - Dialkyl ether - Ether - Azacycle - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Organic nitrogen compound - Organofluoride - Organooxygen compound - Organonitrogen compound - Organic oxide - Hydrocarbon derivative - Alkyl halide - Organohalogen compound - Alkyl fluoride - Organic oxygen compound - Carbonyl group - 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