Compound Identification
SMILES
[Br-].COC1[C@]2(O)C[C@@H]3[C@@]1(O)[C@](O)(CC2OC)C1C[C@H]2C33[C@@H]1[NH+](C)CC2(CC(=O)C1=CC=CC=C1NC(C)=O)CCC3OC
InChIKey
InChIKey=DUHCHCGKLJHQCG-JOJFFJMOSA-N
Formula
C32H45BrN2O8
Mass
665.622
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic oxygen compounds
-
Class
Organooxygen compounds
-
Subclass
Carbonyl compounds
-
Level 5
Ketones
-
Level 6
Aryl ketones
-
Level 7
Phenylketones
- Level 8 Alkyl-phenylketones
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Level 7
Phenylketones
-
Level 6
Aryl ketones
-
Level 5
Ketones
-
Subclass
Carbonyl compounds
-
Class
Organooxygen compounds
-
Superclass
Organic oxygen compounds
Kingdom
Organic compounds
Superclass
Organic oxygen compounds
Class
Organooxygen compounds
Subclass
Carbonyl compounds
Intermediate Tree Nodes
Ketones - Aryl ketones - Phenylketones
Direct Parent
Alkyl-phenylketones
Alternative Parents
Acetanilides Quinolidines N-acetylarylamines Aryl alkyl ketones Benzoyl derivatives Azepanes Piperidines Gamma-amino ketones Vinylogous amides Acetamides Tertiary alcohols Amino acids and derivatives Trialkylamines Secondary carboxylic acid amides Cyclic alcohols and derivatives Polyols Azacyclic compounds Dialkyl ethers Organopnictogen compounds Organic oxides Organic bromide salts Hydrocarbon derivatives Organic zwitterions
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alkyl-phenylketone - Acetanilide - Quinolidine - N-acetylarylamine - Anilide - N-arylamide - Aryl alkyl ketone - Benzoyl - Azepane - Piperidine - Benzenoid - Monocyclic benzene moiety - Gamma-aminoketone - Tertiary alcohol - Vinylogous amide - Cyclic alcohol - Acetamide - Carboxamide group - Tertiary amine - Secondary carboxylic acid amide - Amino acid or derivatives - Tertiary aliphatic amine - Azacycle - Carboxylic acid derivative - Organoheterocyclic compound - Dialkyl ether - Ether - Polyol - Organic nitrogen compound - Amine - Organic bromide salt - Alcohol - Hydrocarbon derivative - Organopnictogen compound - Organic salt - Organonitrogen compound - Organic zwitterion - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as alkyl-phenylketones. These are aromatic compounds containing a ketone substituted by one alkyl group, and a phenyl group.
External Descriptors
Not available