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Substance Name: Diiodo-philanthotoxin-343-lysine
RN: 134419-07-1
InChIKey: XXKIHKWOYBOYNY-RNOIDMDUSA-N

Molecular Formula

  • C29-H51-I2-N7-O4

Molecular Weight

  • 811.7669
 
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Names and Synonyms

Name of Substance

  • Diiodo-philanthotoxin-343-lysine

Synonym

  • I-Phtx-343-lys

Systematic Name

  • Benzenepropanamide, N-(3-((4-((3-((2,6-diamino-1-oxohexyl)amino)propyl)amino)butyl)amino)propyl)-4-hydroxy-3,5-di(iodo-125I)-alpha-((1-oxobutyl)amino)-, (S-(R*,R*))-

Registry Numbers

CAS Registry Number

  • 134419-07-1

System Generated Number

  • 0134419071

Structure Descriptors

InChI

1S/C29H51I2N7O4/c1-2-9-26(39)38-25(20-21-18-22(30)27(40)23(31)19-21)29(42)37-17-8-15-35-13-6-5-12-34-14-7-16-36-28(41)24(33)10-3-4-11-32/h18-19,24-25,34-35,40H,2-17,20,32-33H2,1H3,(H,36,41)(H,37,42)(H,38,39)/t24-,25-/m0/s1/i30-2,31-2

InChIKey

XXKIHKWOYBOYNY-RNOIDMDUSA-N

Smiles

CCCC(=O)N[C@@H](Cc1cc(c(c(c1)[125I])O)[125I])C(=O)NCCCNCCCCNCCCNC(=O)[C@H](CCCCN)N