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Substance Name: Technetium Tc-99m trofolastat cation
RN: 1333204-77-5
UNII: W23EFJ3KDD
InChIKey: AKSTZCFBBAPADU-ACJQYMCTSA-N

Molecular Formula

  • C30-H45-N9-O12.3C-O.Tc

Molecular Weight

  • 906.7665
 
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Names and Synonyms

Name of Substance

  • Technetium Tc-99m trofolastat cation

Synonyms

  • (OC-6-33)-Tricarbonyl(N2-(((1S)-1,3-dicarboxypropyl)carbamoyl)-L-gamma-glutamyl-N6,N6-bis((1-(2-(bis(carboxymethyl)amino)-2-oxoethyl)-1H-imidazol-2-yl-kappaN3)methyl)-L-lysine-kappaN6)(99mtc)technetium(+)
  • Technetium Tc-99m trofolastat cation
  • UNII-W23EFJ3KDD

Registry Numbers

CAS Registry Number

  • 1333204-77-5

FDA UNII

  • W23EFJ3KDD

System Generated Number

  • 1333204775

Structure Descriptors

InChI

1S/C30H45N9O12.3CO.Tc/c31-19(27(46)34-9-3-1-6-20(28(47)48)35-30(51)36-21(29(49)50)7-8-24(40)41)5-2-4-12-37(15-22-32-10-13-38(22)17-25(42)43)16-23-33-11-14-39(23)18-26(44)45;3*1-2;/h10-11,13-14,19-21H,1-9,12,15-18,31H2,(H,34,46)(H,40,41)(H,42,43)(H,44,45)(H,47,48)(H,49,50)(H2,35,36,51);;;;/q;;;;+1/t19-,20-,21-;;;;/m0..../s1/i;;;;1+1

InChIKey

AKSTZCFBBAPADU-ACJQYMCTSA-N

Smiles

[C-]#[O+].[C-]#[O+].[C-]#[O+].c1cn(c(n1)CN(CCCC[C@@H](C(=O)NCCCC[C@@H](C(=O)O)NC(=O)N[C@@H](CCC(=O)O)C(=O)O)N)Cc2nccn2CC(=O)O)CC(=O)O.[99Tc+]