Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: EINECS 277-449-6
RN: 73398-51-3
InChIKey: PRNSJPKDFLLHNR-ZXKDDXFLSA-J

Classification Code

  • TSCA Flag PMN (a Commenced PMN (Premanufacture Notice) Substance)

Molecular Formula

  • C40-H36-N10-O17-S4.4Na

Molecular Weight

  • 1144.97
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Regulatory Agencies (Superlist Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Results Name

  • EINECS 277-449-6

Synonym

  • EINECS 277-449-6

Systematic Names

  • 2,7-Naphthalenedisulfonic acid, 4-hydroxy-5-((4-((4-((2-hydroxyethyl)amino)-6-((5-hydroxy-6-((2-methoxy-5-sulfophenyl)azo)-7-sulfo-2-naphthalenyl)amino)-1,3,5-triazin-2-yl)amino)-5-methoxy-2-methylphenyl)azo)-, tetrasodium salt
  • 2,7-Naphthalenedisulfonic acid, 4-hydroxy-5-(2-(4-((4-((2-hydroxyethyl)amino)-6-((5-hydroxy-6-(2-(2-methoxy-5-sulfophenyl)diazenyl)-7-sulfo-2-naphthalenyl)amino)-1,3,5-triazin-2-yl)amino)-5-methoxy-2-methylphenyl)diazenyl)-, sodium salt (1:4)

Registry Numbers

CAS Registry Number

  • 73398-51-3

System Generated Number

  • 0073398513

Molecular Formulas

Molecular Formula

  • C40-H36-N10-O17-S4.4Na

Molecular Formula Fragments

  • C40-H36-N10-O17-S4
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C40H36N10O17S4.4Na/c1-19-10-28(33(67-3)18-27(19)47-49-30-16-24(69(57,58)59)12-21-13-25(70(60,61)62)17-31(52)35(21)30)43-40-45-38(41-8-9-51)44-39(46-40)42-22-4-6-26-20(11-22)14-34(71(63,64)65)36(37(26)53)50-48-29-15-23(68(54,55)56)5-7-32(29)66-2;;;;/h4-7,10-18,51-53H,8-9H2,1-3H3,(H,54,55,56)(H,57,58,59)(H,60,61,62)(H,63,64,65)(H3,41,42,43,44,45,46);;;;/q;4*+1/p-4/b49-47+,50-48+;;;;

InChIKey

PRNSJPKDFLLHNR-ZXKDDXFLSA-J

Smiles

[Na+].[Na+].[Na+].[Na+].c1c(cc(c2c(cc(cc12)S(=O)(=O)[O-])\N=N\c1c(cc(c(c1)OC)Nc1nc(nc(n1)NCCO)Nc1cc2cc(c(c(c2cc1)O)\N=N\c1c(ccc(c1)S(=O)(=O)[O-])OC)S(=O)(=O)[O-])C)O)S(=O)(=O)[O-]