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[3-hexadecanoyloxy-2-[8-[1-[4-[3-(trifluoromethyl)diazirin-1-yl]phenyl]ethoxy]octanoyloxy]propyl] 2-(trimethylazaniumyl)ethyl phosphate

[3-hexadecanoyloxy-2-[8-[1-[4-[3-(trifluoromethyl)diazirin-1-yl]phenyl]ethoxy]octanoyloxy]propyl] 2-(trimethylazaniumyl)ethyl phosphate structure

CAS No:
124199-66-2
Formula:
C42H71F3N3O9P
Chemical Name:
[3-hexadecanoyloxy-2-[8-[1-[4-[3-(trifluoromethyl)diazirin-1-yl]phenyl]ethoxy]octanoyloxy]propyl] 2-(trimethylazaniumyl)ethyl phosphate
Synonyms:
1-palmitoyl-2-(10-(4-((trifluoro-methyl)diazirinyl)phenyl)-9-oxaundecanoyl)-sn-glycero-3-phosphocholine;PTFDPUGP;Ptfdpugp;124199-66-2;DTXSID50924747;1-Palmitoyl-2-(10-(4-((trifluoro-methyl)diazirinyl)phenyl)-9-oxaundecanoyl)-sn-glycero-3-phosphocholine;3,5,8,17-Tetraoxa-4-phophanonadecan-1-aminium, 4-hydroxy-N,N,N-trimethyl-9-oxo-8-(((1-oxohexadecyl)oxy)methyl)-18-(4-(((trifluoromethyl)azo)methyl)phenyl)-, hydroxide, inner salt, 4-oxide;3-(Hexadecanoyloxy)-2-{[8-(1-{4-[3-(trifluoromethyl)-1H-diaziren-1-yl]phenyl}ethoxy)octanoyl]oxy}propyl 2-(trimethylazaniumyl)ethyl phosphate

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[3-hexadecanoyloxy-2-[8-[1-[4-[3-(trifluoromethyl)diazirin-1-yl]phenyl]ethoxy]octanoyloxy]propyl] 2-(trimethylazaniumyl)ethyl phosphate Basic Attributes

Molecular Weight：

850.0 g/mol

Exact Mass：

849.48800233 g/mol

Characteristics

PSA：

136 Å²

Drug Information

MeSH Entry Terms：

1-palmitoyl-2-(10-(4-((trifluoro-methyl)diazirinyl)phenyl)-9-oxaundecanoyl)-sn-glycero-3-phosphocholine

Computed Properties

Molecular Weight:850.0
XLogP3:10.5
Hydrogen Bond Acceptor Count:13
Rotatable Bond Count:37
Exact Mass:849.48800233
Monoisotopic Mass:849.48800233
Topological Polar Surface Area:136
Heavy Atom Count:58
Complexity:1200
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of [3-hexadecanoyloxy-2-[8-[1-[4-[3-(trifluoromethyl)diazirin-1-yl]phenyl]ethoxy]octanoyloxy]propyl] 2-(trimethylazaniumyl)ethyl phosphate

Basic Attributes
Characteristics
Drug Information
Computed Properties
Learn More Other Chemicals

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