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CHEBI:39059 - 10-(perfluorobutyl)decyl phosphatidylcholine

ChEBI IDCHEBI:39059
ChEBI Name10-(perfluorobutyl)decyl phosphatidylcholine
Stars
Last Modified21 April 2008
Submitterhcourrier
DownloadsMolfile
FormulaC38H59F18NO8P
Net Charge+1
Average Mass1030.827
Monoisotopic Mass1030.36854
SMILESC[N+](C)(C)CCOP(=O)(O)OCC(COC(=O)CCCCCCCCCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)F)OC(=O)CCCCCCCCCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)F
InChIInChI=1S/C38H58F18NO8P/c1-57(2,3)24-25-63-66(60,61)64-27-28(65-30(59)21-17-13-9-5-7-11-15-19-23-32(41,42)34(45,46)36(49,50)38(54,55)56)26-62-29(58)20-16-12-8-4-6-10-14-18-22-31(39,40)33(43,44)35(47,48)37(51,52)53/h28H,4-27H2,1-3H3/p+1
InChIKeyIHPBOVQCHVYNKK-UHFFFAOYSA-O
ChEBI Ontology
Outgoing Relation(s)
10-(perfluorobutyl)decyl phosphatidylcholine (CHEBI:39059) is a organofluorine compound (CHEBI:37143)
10-(perfluorobutyl)decyl phosphatidylcholine (CHEBI:39059) is a phosphatidylcholine(1+) (CHEBI:49183)
IUPAC Name 
21,21,22,22,23,23,24,24,24-nonafluoro-4-hydroxy-N,N,N-trimethyl-7-[(12,12,13,13,14,14,15,15,15-nonafluoropentadecanoyl)oxy]-10-oxo-3,5,9-trioxa-4-phosphatetracosan-1-aminium 4-oxide