Compound Identification
SMILES
COC(=O)[C@@]1(CC(=O)[C@@H]2C[C@@]3(CN2C(=O)[C@H](CCCCCC=C)CC(=O)OC(C)(C)C)CC(=NO3)C2=CC(Cl)=CC=C2)C[C@H]1C=C
InChIKey
InChIKey=LDFJQJQNUHCSJF-MGZCGMIUSA-N
Formula
C36H47ClN2O7
Mass
655.23
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
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Class
Keto acids and derivatives
- Subclass Gamma-keto acids and derivatives
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Class
Keto acids and derivatives
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Superclass
Organic acids and derivatives
Kingdom
Organic compounds
Superclass
Organic acids and derivatives
Class
Keto acids and derivatives
Subclass
Gamma-keto acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Gamma-keto acids and derivatives
Alternative Parents
N-acylpyrrolidines Chlorobenzenes Fatty acid esters Aryl chlorides Cyclopropanecarboxylic acids and derivatives Dicarboxylic acids and derivatives Tertiary carboxylic acid amides Isoxazolines Methyl esters Tertiary amines Amino acids and derivatives Ketones Oxacyclic compounds Azacyclic compounds Hydrocarbon derivatives Organic oxides Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Gamma-keto acid - N-acylpyrrolidine - Chlorobenzene - Fatty acid ester - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Cyclopropanecarboxylic acid or derivatives - Dicarboxylic acid or derivatives - Benzenoid - Fatty acyl - Pyrrolidine - Methyl ester - Tertiary carboxylic acid amide - Isoxazoline - Tertiary amine - Carboxamide group - Carboxylic acid ester - Amino acid or derivatives - Ketone - Organoheterocyclic compound - Carboxylic acid derivative - Azacycle - Oxacycle - Organic oxide - Organic oxygen compound - Amine - Organic nitrogen compound - Carbonyl group - Organonitrogen compound - Hydrocarbon derivative - Organochloride - Organooxygen compound - Organohalogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as gamma-keto acids and derivatives. These are organic compounds containing an aldehyde substituted with a keto group on the C4 carbon atom.
External Descriptors
Not available