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Substance Name: CP-18 F-18
RN: 1193087-67-0
UNII: UE830U0CWL
InChIKey: SZXPYKHOFVWUDG-XXVAWOGHSA-N

Molecular Formula

  • C46-H73-F-N10-O23

Molecular Weight

  • 1152.126
 
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Names and Synonyms

Name of Substance

  • CP-18 F-18

Synonyms

  • (18F)-CP18
  • CP-18 F-18
  • L-Alaninamide, N-(2,6-anhydro-7-deoxy-7-((2-(4-(3-(fluoro-18F)propyl)-1H-1,2,3-triazol-1-yl)acetyl)amino)-L-glycero-L-galacto-heptonoyl)-L-alpha-aspartyl-L-alpha-glutamyl-L-valyl-L-alpha-aspartyl-N-(14-carboxy-3,6,9,12-tetraoxatetradec-1-yl)-
  • UNII-UE830U0CWL

Registry Numbers

CAS Registry Number

  • 1193087-67-0

FDA UNII

  • UE830U0CWL

System Generated Number

  • 1193087670

Structure Descriptors

InChI

1S/C46H73FN10O23/c1-24(2)36(45(74)52-28(19-34(63)64)43(72)50-25(3)41(70)48-10-12-77-14-16-79-18-17-78-15-13-76-11-8-33(61)62)54-42(71)27(6-7-32(59)60)51-44(73)29(20-35(65)66)53-46(75)40-39(69)38(68)37(67)30(80-40)21-49-31(58)23-57-22-26(55-56-57)5-4-9-47/h22,24-25,27-30,36-40,67-69H,4-21,23H2,1-3H3,(H,48,70)(H,49,58)(H,50,72)(H,51,73)(H,52,74)(H,53,75)(H,54,71)(H,59,60)(H,61,62)(H,63,64)(H,65,66)/t25-,27-,28-,29-,30-,36-,37-,38+,39+,40-/m0/s1/i47-1

InChIKey

SZXPYKHOFVWUDG-XXVAWOGHSA-N

Smiles

CC(C)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H]1O[C@@H](CNC(=O)Cn2cc(CCC[18F])nn2)[C@H](O)[C@@H](O)[C@H]1O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C)C(=O)NCCOCCOCCOCCOCCC(=O)O