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Substance Name: 1,6,11,16-Tetra-(epsilon-N-dnp)-L-lysine(16)
RN: 80462-89-1
InChIKey: WELASGRDIFMJSO-HDQFLVCLSA-N

Note

  • Tetravalent dinitrophenyl hapten.

Molecular Weight

  • 2733.1628
 
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Names and Synonyms

Name of Substance

  • 1,6,11,16-Tetra-(epsilon-N-dnp)-L-lysine(16)

Synonym

  • T-Dnp-lys

Systematic Name

  • L-Lysine, N6-(2,4-dinitrophenyl)-L-lysyl-L-lysyl-L-lysyl-L-lysyl-L-lysyl-N6-(2,4-dinitrophenyl)-L-lysyl-L-lysyl-L-lysyl-L-lysyl-L-lysyl-N6-(2,4-dinitrophenyl)-L-lysyl-L-lysyl-L-lysyl-L-lysyl-L-lysyl-N6-(2,4-dinitrophenyl)-

Registry Numbers

CAS Registry Number

  • 80462-89-1

System Generated Number

  • 0080462891

Structure Descriptors

InChI

1S/C120H202N40O33/c121-57-17-1-36-88(140-108(165)92(40-5-21-61-125)144-112(169)93(41-6-22-62-126)145-109(166)89(37-2-18-58-122)141-105(162)81(133)33-13-29-69-136-84-52-48-77(153(178)179)73-100(84)157(186)187)104(161)120(119(176)177,56-16-32-72-139-87-55-51-80(156(184)185)76-103(87)160(192)193)152(117(174)98(46-11-27-67-131)150-115(172)96(44-9-25-65-129)148-113(170)94(42-7-23-63-127)146-110(167)90(38-3-19-59-123)142-106(163)82(134)34-14-30-70-137-85-53-49-78(154(180)181)74-101(85)158(188)189)118(175)99(47-12-28-68-132)151-116(173)97(45-10-26-66-130)149-114(171)95(43-8-24-64-128)147-111(168)91(39-4-20-60-124)143-107(164)83(135)35-15-31-71-138-86-54-50-79(155(182)183)75-102(86)159(190)191/h48-55,73-76,81-83,88-99,136-139H,1-47,56-72,121-135H2,(H,140,165)(H,141,162)(H,142,163)(H,143,164)(H,144,169)(H,145,166)(H,146,167)(H,147,168)(H,148,170)(H,149,171)(H,150,172)(H,151,173)(H,176,177)/t81-,82-,83-,88-,89-,90-,91-,92-,93-,94-,95-,96-,97-,98-,99-,120+/m0/s1

InChIKey

WELASGRDIFMJSO-HDQFLVCLSA-N

Smiles

c1cc(c(cc1[N+](=O)[O-])[N+](=O)[O-])NCCCC[C@@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)[C@](CCCCNc2ccc(cc2[N+](=O)[O-])[N+](=O)[O-])(C(=O)O)N(C(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCNc3ccc(cc3[N+](=O)[O-])[N+](=O)[O-])N)C(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCNc4ccc(cc4[N+](=O)[O-])[N+](=O)[O-])N)N