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Substance Name: FP 21399
RN: 170020-61-8
UNII: NZR4S1X98O
InChIKey: JZGXIWOIOQUZFS-BEZIOABYSA-J

Classification Code

  • Fusion Inhibitor

Molecular Formula

  • C40-H24-Cl4-N6-O16-S4.4Na

Molecular Weight

  • 1262.7116
 
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Names and Synonyms

Name of Substance

  • FP 21399

Synonyms

  • FP-21399
  • UNII-NZR4S1X98O

Systematic Name

  • 2,7-Naphthalenedisulfonic acid, 5-((2,3-dichlorobenzoyl)amino)-3-((4-((8-((2,4-dichlorobenzoyl)amino)-1-hydroxy-3,6-disulfo-2-naphthalenyl)azo)phenyl)azo)-4-hydroxy-, tetrasodium salt

Registry Numbers

CAS Registry Number

  • 170020-61-8

FDA UNII

  • NZR4S1X98O

System Generated Number

  • 0170020618

Molecular Formulas

Molecular Formula

  • C40-H24-Cl4-N6-O16-S4.4Na

Molecular Formula Fragments

  • C40-H24-Cl4-N6-O16-S4
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C42H28Cl4N6O18S4.4Na/c1-69-30-16-27(50-52-38-33(74(66,67)68)11-18-9-21(72(60,61)62)14-29(35(18)40(38)54)48-42(56)23-4-3-5-24(44)36(23)46)31(70-2)15-26(30)49-51-37-32(73(63,64)65)10-17-8-20(71(57,58)59)13-28(34(17)39(37)53)47-41(55)22-7-6-19(43)12-25(22)45;;;;/h3-16,53-54H,1-2H3,(H,47,55)(H,48,56)(H,57,58,59)(H,60,61,62)(H,63,64,65)(H,66,67,68);;;;/q;4*+1/p-4/b51-49+,52-50+;;;;

InChIKey

JZGXIWOIOQUZFS-BEZIOABYSA-J

Smiles

COc1cc(c(cc1/N=N/c2c(cc3cc(cc(c3c2O)NC(=O)c4cccc(c4Cl)Cl)S(=O)(=O)[O-])S(=O)(=O)[O-])OC)/N=N/c5c(cc6cc(cc(c6c5O)NC(=O)c7ccc(cc7Cl)Cl)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]