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Substance Name: 1-Palmitoyl-2-(10-(4-((trifluoro-methyl)diazirinyl)phenyl)-9-oxaundecanoyl)-sn-glycero-3-phosphocholine
RN: 124199-66-2
InChIKey: OZZUFVVEXPZPKT-UHFFFAOYSA-N

Molecular Formula

  • C42-H73-F3-N3-O9-P

Molecular Weight

  • 850.003
 
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Names and Synonyms

Name of Substance

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

Synonym

  • Ptfdpugp

Systematic Name

  • 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

Registry Numbers

CAS Registry Number

  • 124199-66-2

System Generated Number

  • 0124199662

Structure Descriptors

InChI

1S/C42H71F3N3O9P/c1-6-7-8-9-10-11-12-13-14-15-16-18-21-24-39(49)54-33-38(34-56-58(51,52)55-32-30-48(3,4)5)57-40(50)25-22-19-17-20-23-31-53-35(2)36-26-28-37(29-27-36)47-41(46-47)42(43,44)45/h26-29,35,38H,6-25,30-34H2,1-5H3

InChIKey

OZZUFVVEXPZPKT-UHFFFAOYSA-N

Smiles

O(C[C@@H](OC(CCCCCCCO[C@@H](C)c1ccc(cc1)N1N=C1C(F)(F)F)=O)COP(=O)([O-])OCC[N+](C)(C)C)C(CCCCCCCCCCCCCCC)=O