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Substance Name: TRP-601
RN: 1094569-02-4
UNII: XF7CQ628XY
InChIKey: UKOOXNFTVLKWED-HRNCDAKQSA-N

Note

  • A caspase inhibitor.

Molecular Formula

  • C40-H48-F2-N6-O11

Molecular Weight

  • 826.8395
 
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Names and Synonyms

Name of Substance

  • TRP-601

Synonyms

  • 5-(2,6-Difluoro-phenoxy)-3(R,S)-(2(S)-(2(S)-(3-methoxycarbonyl-2(S)-(3-methyl-2(S)-((quinoline-2-carbonyl)-amino)-butyrylamino)-propionylamino)-3-methyl-butyrylamino)-propionylamino)-4-oxo-pentanoic acid methyl ester
  • L-Alaninamide, N-(2-quinolinylcarbonyl)-L-valyl-L-alpha-aspartyl-L-valyl-N-(3-(2,6-difluorophenoxy)-1-(2-methoxy-2-oxoethyl)-2-oxopropyl)-, methyl ester
  • Methyl-(3S)-5-(2,6-difluorophenoxy)-3-((((4-methoxy-4-oxo-butanoyl)-(3-methylbutanoyl-(quinoline-2-carbonylamino)amino)amino)-(3-methylbutanoyl)amino)-propanoyl-amino)-4-oxo-pentanoate
  • TRP-601
  • UNII-XF7CQ628XY

Registry Numbers

CAS Registry Number

  • 1094569-02-4

FDA UNII

  • XF7CQ628XY

System Generated Number

  • 1094569024

Structure Descriptors

InChI

1S/C40H48F2N6O11/c1-20(2)33(39(55)43-22(5)36(52)45-28(17-31(50)57-6)30(49)19-59-35-24(41)12-10-13-25(35)42)48-38(54)29(18-32(51)58-7)46-40(56)34(21(3)4)47-37(53)27-16-15-23-11-8-9-14-26(23)44-27/h8-16,20-22,28-29,33-34H,17-19H2,1-7H3,(H,43,55)(H,45,52)(H,46,56)(H,47,53)(H,48,54)/t22-,28?,29-,33-,34-/m0/s1

InChIKey

UKOOXNFTVLKWED-HRNCDAKQSA-N

Smiles

COC(=O)CC(NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)OC)NC(=O)[C@@H](NC(=O)c1ccc2ccccc2n1)C(C)C)C(C)C)C(=O)COc3c(F)cccc3F