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4-[4-(dimethylamino)pyridin-1-ium-1-yl]butyl (2-ethoxy-3-hexadecoxypropyl) phosphate

4-[4-(dimethylamino)pyridin-1-ium-1-yl]butyl (2-ethoxy-3-hexadecoxypropyl) phosphate structure

CAS No:
132657-47-7
Formula:
C32H61N2O6P
Chemical Name:
4-[4-(dimethylamino)pyridin-1-ium-1-yl]butyl (2-ethoxy-3-hexadecoxypropyl) phosphate
Synonyms:
1-O-hexadecyl-2-O-ethylglycero-3-phosphoric acid 4-(N,N-dimethylamino)pyridinium butylester;KO 286011;KO-286011;Methanaminium, N-(1-(9-ethoxy-6-hydroxy-5,7,11-trioxa-6-phosphaheptacos-1-yl)-4(1H)-pyridinylidene)-N-methyl-, hydroxide, inner salt, P-oxide, (+-)-;132657-47-7;KO 286011;KO-286011;DTXSID80927761;1-O-Hexadecyl-2-O-ethylglycero-3-phosphoric acid 4-(N,N-dimethylamino)pyridinium butylester;4-[4-(Dimethyliminio)pyridin-1(4H)-yl]butyl 2-ethoxy-3-(hexadecyloxy)propyl phosphate;Methanaminium, N-(1-(9-ethoxy-6-hydroxy-5,7,11-trioxa-6-phosphaheptacos-1-yl)-4(1H)-pyridinylidene)-N-methyl-, hydroxide, inner salt, P-oxide, (+-)-

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4-[4-(dimethylamino)pyridin-1-ium-1-yl]butyl (2-ethoxy-3-hexadecoxypropyl) phosphate Basic Attributes

Molecular Weight：

600.8 g/mol

Exact Mass：

600.42672467 g/mol

Characteristics

PSA：

84.2 Å²

Drug Information

MeSH Entry Terms：

1-O-hexadecyl-2-O-ethylglycero-3-phosphoric acid 4-(N,N-dimethylamino)pyridinium butylester

Computed Properties

Molecular Weight:600.8
XLogP3:8.3
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:29
Exact Mass:600.42672467
Monoisotopic Mass:600.42672467
Topological Polar Surface Area:84.2
Heavy Atom Count:41
Complexity:611
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-[4-(dimethylamino)pyridin-1-ium-1-yl]butyl (2-ethoxy-3-hexadecoxypropyl) phosphate

Basic Attributes
Characteristics
Drug Information
Computed Properties
Learn More Other Chemicals

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