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Substance Name: 3,7-Diamino-2-hydroxyheptanoic acid-2-(2-nitrophenylsulfenyl)tryptophan methyl ester
RN: 138257-79-1
InChIKey: MFFKDZWEEBNNMI-MSYCTHLASA-N

Molecular Formula

  • C25-H31-N5-O6-S

Molecular Weight

  • 529.615
 
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Names and Synonyms

Name of Substance

  • 3,7-Diamino-2-hydroxyheptanoic acid-2-(2-nitrophenylsulfenyl)tryptophan methyl ester

Synonym

  • Dha-trpnps

Systematic Name

  • L-Tryptophan, N-(3,7-diamino-2-hydroxy-1-oxoheptyl)-1-((2-nitrophenyl)thio)-, methyl ester, (S-(R*,S*))-

Registry Numbers

CAS Registry Number

  • 138257-79-1

System Generated Number

  • 0138257791

Structure Descriptors

InChI

1S/C25H31N5O6S/c1-36-25(33)19(28-24(32)23(31)18(27)9-6-7-13-26)14-16-15-29(20-10-3-2-8-17(16)20)37-22-12-5-4-11-21(22)30(34)35/h2-5,8,10-12,15,18-19,23,31H,6-7,9,13-14,26-27H2,1H3,(H,28,32)/t18-,19+,23+/m1/s1

InChIKey

MFFKDZWEEBNNMI-MSYCTHLASA-N

Smiles

C([C@@H](NC([C@H]([C@@H](CCCCN)N)O)=O)Cc1cn(c2ccccc12)Sc1c(cccc1)[N+](=O)[O-])(=O)OC