Compound Identification
SMILES
CCCCCCCCCCCCCCCCOP([O-])(=O)OCC[N+](C)(C)C.ClC1=CC2=C(C=C1)N(C1CCN(CCCN3C(=O)NC4=CC=CC=C34)CC1)C(=O)N2
InChIKey
InChIKey=JUFRYXBOUUWCSZ-UHFFFAOYSA-N
Formula
C43H70ClN6O6P
Mass
833.49
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic nitrogen compounds
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Class
Organonitrogen compounds
-
Subclass
Quaternary ammonium salts
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Level 5
Cholines
- Level 6 Phosphocholines
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Level 5
Cholines
-
Subclass
Quaternary ammonium salts
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Class
Organonitrogen compounds
-
Superclass
Organic nitrogen compounds
Kingdom
Organic compounds
Superclass
Organic nitrogen compounds
Class
Organonitrogen compounds
Subclass
Quaternary ammonium salts
Intermediate Tree Nodes
Cholines
Direct Parent
Phosphocholines
Alternative Parents
Benzimidazoles Dialkyl phosphates Piperidines Aryl chlorides Benzenoids N-substituted imidazoles Tetraalkylammonium salts Heteroaromatic compounds Ureas Trialkylamines Azacyclic compounds Hydrocarbon derivatives Organic oxides Organic salts Organic zwitterions Organochlorides Organooxygen compounds
Molecular Framework
Not available
Substituents
Phosphocholine - Benzimidazole - Dialkyl phosphate - Aryl chloride - Aryl halide - N-substituted imidazole - Benzenoid - Organic phosphoric acid derivative - Alkyl phosphate - Phosphoric acid ester - Piperidine - Tetraalkylammonium salt - Azole - Heteroaromatic compound - Imidazole - Urea - Tertiary aliphatic amine - Tertiary amine - Organoheterocyclic compound - Azacycle - Organooxygen compound - Organochloride - Organic zwitterion - Organohalogen compound - Organic salt - Hydrocarbon derivative - Organic oxide - Amine - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phosphocholines. These are compounds containing a [2-(trimethylazaniumyl)ethoxy]phosphonic acid or derivative.
External Descriptors
Not available