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PFS

Summary
Name:(2R)-2-(acetyloxy)-3-(hexadecyloxy)propyl 2-(trimethylammonio)ethyl phosphate
Synonyms:PLATELET ACTIVATING FACTOR
Formula:C26 H54 N O7 P
Formal charge:0
Formula weight:523.683 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs12.01(2R)-2-(acetyloxy)-3-(hexadecyloxy)propyl 2-(trimethylammonio)ethyl phosphate
OpenEye OEToolkits1.7.6[(2R)-2-acetyloxy-3-hexadecoxy-propyl] 2-(trimethylazaniumyl)ethyl phosphate

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01[O-]P(=O)(OCC(OC(=O)C)COCCCCCCCCCCCCCCCC)OCC[N+](C)(C)C
InChIInChI1.03InChI=1S/C26H54NO7P/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21-31-23-26(34-25(2)28)24-33-35(29,30)32-22-20-27(3,4)5/h26H,6-24H2,1-5H3/t26-/m1/s1
InChIKeyInChI1.03HVAUUPRFYPCOCA-AREMUKBSSA-N
SMILES_CANONICALCACTVS3.385CCCCCCCCCCCCCCCCOC[C@H](CO[P]([O-])(=O)OCC[N+](C)(C)C)OC(C)=O
SMILESCACTVS3.385CCCCCCCCCCCCCCCCOC[CH](CO[P]([O-])(=O)OCC[N+](C)(C)C)OC(C)=O
SMILES_CANONICALOpenEye OEToolkits1.7.6CCCCCCCCCCCCCCCCOC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)C
SMILESOpenEye OEToolkits1.7.6CCCCCCCCCCCCCCCCOCC(COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)C

223532

건을2024-08-07부터공개중

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