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Substance Name: Anthra(2,1,9-mna)naphth(2,3-h)acridine-5,10,15-triol, 5,10,15-tris(hydrogen sulfate), sodium salt (1:3)
RN: 13390-52-8
InChIKey: XOZXHOVHPXPMBW-UHFFFAOYSA-K

Molecular Formula

  • C31-H17-N-O12-S3.3Na

Molecular Weight

  • 759.63
 
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Names and Synonyms

Synonym

  • EINECS 236-466-9

Systematic Names

  • Anthra(2,1,9-mna)naphth(2,3-h)acridine-5,10,15-triol, 5,10,15-tris(hydrogen sulfate), sodium salt (1:3)
  • Anthra(2,1,9-mna)naphth(2,3-h)acridine-5,10,15-triol, tris(hydrogen sulfate) (ester), trisodium salt
  • Trisodium anthra(2,1,9-mna)naphth(2,3-h)acridine-5,10,15-triyl tris(sulphate)

Registry Numbers

CAS Registry Number

  • 13390-52-8

System Generated Number

  • 0013390528

Molecular Formulas

Molecular Formula

  • C31-H17-N-O12-S3.3Na

Molecular Formula Fragments

  • C31-H17-N-O12-S3
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C31H19NO12S3.3Na/c33-45(34,35)42-29-19-6-2-1-5-15(19)16-13-14-24-26-17(9-11-22(29)25(16)26)18-10-12-23-27(28(18)32-24)31(44-47(39,40)41)21-8-4-3-7-20(21)30(23)43-46(36,37)38;;;/h1-8,10-14,25H,9H2,(H,33,34,35)(H,36,37,38)(H,39,40,41);;;/q;3*+1/p-3

InChIKey

XOZXHOVHPXPMBW-UHFFFAOYSA-K

Smiles

[Na+].[Na+].[Na+].[O-]S(Oc1c2ccccc2c(c2c3nc4C=CC=5[C@@H]6c4c(c3ccc12)CC=C6C(=c1ccccc51)OS(=O)(=O)[O-])OS(=O)(=O)[O-])(=O)=O