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Substance Name: Sodium tetra(4-sulfophenyl)porphinatocopper
RN: 67204-03-9
InChIKey: ILUPFNGQEQFLQR-FLYAKZGESA-J

Molecular Formula

  • C44-H24-Cu-N4-O12-S4.4Na

Molecular Weight

  • 1086.48
 
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Names and Synonyms

Results Name

  • Sodium tetra(4-sulfophenyl)porphinatocopper

Synonym

  • Sodium tetra(4-sulfophenyl)porphinatocopper

Systematic Name

  • Cuprate(4-), ((4,4',4'',4'''-(21H,23H-porphine-5,10,15,20-tetrayl)tetrakis(benzenesulfonato))(6)-N(sup 21),N(sup 22),N(sup 23),N(sup 24))-, tetrasodium, (SP-4-1)-

Registry Numbers

CAS Registry Number

  • 67204-03-9

System Generated Number

  • 0067204039

Molecular Formulas

Molecular Formula

  • C44-H24-Cu-N4-O12-S4.4Na

Molecular Formula Fragments

  • C44-H24-Cu-N4-O12-S4
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C44H28N4O12S4.Cu.4Na/c49-61(50,51)29-9-1-25(2-10-29)41-33-17-19-35(45-33)42(26-3-11-30(12-4-26)62(52,53)54)37-21-23-39(47-37)44(28-7-15-32(16-8-28)64(58,59)60)40-24-22-38(48-40)43(36-20-18-34(41)46-36)27-5-13-31(14-6-27)63(55,56)57;;;;;/h1-24H,(H,49,50,51)(H,52,53,54)(H,55,56,57)(H,58,59,60);;;;;/q-2;+2;4*+1/p-4/b41-33-,41-34-,42-35-,42-37-,43-36-,43-38-,44-39-,44-40-;;;;;

InChIKey

ILUPFNGQEQFLQR-FLYAKZGESA-J

Smiles

[Cu]123n4c5C(c6ccc(S(=O)(=O)[O-])cc6)=c6[n]2c(cc6)C(=c2n1c(=C(c1ccc(S(=O)(=O)[O-])cc1)c1[n]3c(cc1)=C(c4cc5)c1ccc(S(=O)(=O)[O-])cc1)cc2)c1ccc(S(=O)(=O)[O-])cc1.[Na+].[Na+].[Na+].[Na+]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 unreported 80mg/kg (80mg/kg)   Doklady Akademiya Nauk Armyanskoi SSR. Proceedings of the Academy of Sciences of the Armenia SSR. Vol. 78, Pg. 45, 1984.