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Substance Name: N,N'-Bis((epsilon-((2,4-dinitrophenyl)amino)caproyl)tyrosyl)cystine
RN: 104077-25-0
InChIKey: IOXNNJUNZSFOGF-YKKXUYLKSA-N

Molecular Formula

  • C48-H56-N10-O18-S2

Molecular Weight

  • 1125.15
 
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Names and Synonyms

Name of Substance

  • N,N'-Bis((epsilon-((2,4-dinitrophenyl)amino)caproyl)tyrosyl)cystine

Synonyms

  • (Dct)2-cys
  • N-(6-((2,4-Dinitrophenyl)amino)-1-oxohexyl)-L-tyrosyl-L-cysteine (2-2')-disulfide

Systematic Name

  • L-Cysteine, N-(6-((2,4-dinitrophenyl)amino)-1-oxohexyl)-L-tyrosyl-, (2-2')-disulfide

Registry Numbers

CAS Registry Number

  • 104077-25-0

System Generated Number

  • 0104077250

Structure Descriptors

InChI

1S/C48H56N10O18S2/c59-33-15-9-29(10-16-33)23-37(51-43(61)7-3-1-5-21-49-35-19-13-31(55(69)70)25-41(35)57(73)74)45(63)53-39(47(65)66)27-77-78-28-40(48(67)68)54-46(64)38(24-30-11-17-34(60)18-12-30)52-44(62)8-4-2-6-22-50-36-20-14-32(56(71)72)26-42(36)58(75)76/h9-20,25-26,37-40,49-50,59-60H,1-8,21-24,27-28H2,(H,51,61)(H,52,62)(H,53,63)(H,54,64)(H,65,66)(H,67,68)/t37-,38-,39-,40-/m0/s1

InChIKey

IOXNNJUNZSFOGF-YKKXUYLKSA-N

Smiles

C([C@@H](NC([C@@H](NC(CCCCCNc1c(cc(cc1)[N+](=O)[O-])[N+](=O)[O-])=O)Cc1ccc(O)cc1)=O)CSSC[C@H](NC([C@@H](NC(CCCCCNc1c(cc(cc1)[N+](=O)[O-])[N+](=O)[O-])=O)Cc1ccc(O)cc1)=O)C(=O)O)(=O)O