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Substance Name: Pak 104P
RN: 131356-86-0
InChIKey: PFKHLXIJSNUZDT-UHFFFAOYSA-N

Note

  • Used for reversing multidrug resistance.

Molecular Formula

  • C38-H43-N4-O7-P

Molecular Weight

  • 698.753
 
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Names and Synonyms

Name of Substance

  • Pak 104P

Synonyms

  • 2-(4-(Diphenylmethyl)-1-piperazinyl)ethyl 5-(4,6-dimethyl-1,3,2-dioxaphosphorinan-2-yl)-2,6-dimethyl-4-(3-nitrophenyl)-3-pyridinecarboxylate P-oxide
  • Pak-104P

Systematic Name

  • 3-Pyridinecarboxylic acid, 5-(4,6-dimethyl-1,3,2-dioxaphosphorinan-2-yl)-2,6-dimethyl-4-(3-nitrophenyl)-, 2-(4-(diphenylmethyl)-1-piperazinyl)ethyl ester, P-oxide

Registry Numbers

CAS Registry Number

  • 131356-86-0

System Generated Number

  • 0131356860

Structure Descriptors

InChI

1S/C38H43N4O7P/c1-26-24-27(2)49-50(46,48-26)37-29(4)39-28(3)34(35(37)32-16-11-17-33(25-32)42(44)45)38(43)47-23-22-40-18-20-41(21-19-40)36(30-12-7-5-8-13-30)31-14-9-6-10-15-31/h5-17,25-27,36H,18-24H2,1-4H3

InChIKey

PFKHLXIJSNUZDT-UHFFFAOYSA-N

Smiles

c1(c(c(c(c(n1)C)P1(O[C@@H](C[C@@H](O1)C)C)=O)c1cc(ccc1)[N+](=O)[O-])C(=O)OCCN1CCN(CC1)C(c1ccccc1)c1ccccc1)C