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Substance Name: Anthra(9,1,2-cde)benzo(rst)pentaphene-5,10-diol, 16,17-dimethoxy-, 5,10-bis(hydrogen sulfate), sodium salt (1:2)
RN: 2538-84-3
InChIKey: OFRNYPVEFOPHIL-UHFFFAOYSA-L

Molecular Formula

  • C36-H22-O10-S2.2Na

Molecular Weight

  • 722.656
 
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Names and Synonyms

Synonym

  • EINECS 219-809-7

Systematic Names

  • Anthra(9,1,2-cde)benzo(rst)pentaphene-5,10-diol, 16,17-dimethoxy-, 5,10-bis(hydrogen sulfate), sodium salt (1:2)
  • Anthra(9,1,2-cde)benzo(rst)pentaphene-5,10-diol, 16,17-dimethoxy-, bis(hydrogen sulfate), disodium salt
  • Disodium 16,17-dimethoxyanthra(9,1,2-cde)benzo(rst)pentaphene-5,10-diyl bis(sulphate)

Registry Numbers

CAS Registry Number

  • 2538-84-3

System Generated Number

  • 0002538843

Molecular Formulas

Molecular Formula

  • C36-H22-O10-S2.2Na

Molecular Formula Fragments

  • C36-H22-O10-S2
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C36H22O10S2.2Na/c1-43-27-15-25-17-7-3-5-9-21(17)35(45-47(37,38)39)23-13-11-19-20-12-14-24-30-26(18-8-4-6-10-22(18)36(24)46-48(40,41)42)16-28(44-2)34(32(20)30)33(27)31(19)29(23)25;;/h3-16H,1-2H3,(H,37,38,39)(H,40,41,42);;/q;2*+1/p-2

InChIKey

OFRNYPVEFOPHIL-UHFFFAOYSA-L

Smiles

[Na+].[Na+].S(=O)([O-])(=O)Oc1c2ccc3c4c5c6c(cc(c5c5c(cc(c7ccccc17)c2c35)OC)OC)c1ccccc1c(OS(=O)(=O)[O-])c6cc4