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Substance Name: Afridol Blue tetrasodium
RN: 47897-65-4
UNII: UDE8J020KY
InChIKey: ZBIPFCIFJPRLMC-GPTZEZBUSA-J

Classification Code

  • Reproductive Effect

Molecular Formula

  • C32-H18-Cl2-N6-O14-S4.4Na

Molecular Weight

  • 1001.65
 
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Names and Synonyms

Name of Substance

  • Afridol Blue tetrasodium

Synonyms

  • Afridol Blue tetrasodium salt
  • UNII-UDE8J020KY

Systematic Name

  • 2,7-Naphthalenedisulfonic acid, 3,3'-((3,3'-dichloro-4,4'-biphenylylene)bis(azo))bis(5-amino-4-hydroxy-, tetrasodium salt

Registry Numbers

CAS Registry Number

  • 47897-65-4

FDA UNII

  • UDE8J020KY

System Generated Number

  • 0047897654

Molecular Formulas

Molecular Formula

  • C32-H18-Cl2-N6-O14-S4.4Na

Molecular Formula Fragments

  • C32-H18-Cl2-N6-O14-S4
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C32H22Cl2N6O14S4.4Na/c33-19-5-13(1-3-23(19)37-39-31-17-7-15(55(43,44)45)9-21(35)29(17)25(41)11-27(31)57(49,50)51)14-2-4-24(20(34)6-14)38-40-32-18-8-16(56(46,47)48)10-22(36)30(18)26(42)12-28(32)58(52,53)54;;;;/h1-12,41-42H,35-36H2,(H,43,44,45)(H,46,47,48)(H,49,50,51)(H,52,53,54);;;;/q;4*+1/p-4/b39-37+,40-38+;;;;

InChIKey

ZBIPFCIFJPRLMC-GPTZEZBUSA-J

Smiles

c12c(c(cc(c1c(cc(c2)S(=O)(=O)[O-])N)O)S(=O)(=O)[O-])\N=N\c1c(cc(c2cc(c(\N=N\c3c4c(c(O)cc3S(=O)(=O)[O-])c(cc(c4)S(=O)(=O)[O-])N)cc2)Cl)cc1)Cl.[Na+].[Na+].[Na+].[Na+]