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Substance Name: Tripotassium (2S-trans)-18-carboxylato-20-(carboxylatomethyl)-13-ethyl-12-formyl-2,3-dihydro-3,7,17-trimethyl-8-vinyl-21H,23H-porphine-2-propionate
RN: 84580-22-3
InChIKey: ZSFDGFSAUBRWAY-SKRBGUKPSA-N

Molecular Formula

  • C34-H34-N4-O7.3K

Molecular Weight

  • 727.9576
 
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Names and Synonyms

Synonym

  • EINECS 283-204-4

Systematic Name

  • Tripotassium (2S-trans)-18-carboxylato-20-(carboxylatomethyl)-13-ethyl-12-formyl-2,3-dihydro-3,7,17-trimethyl-8-vinyl-21H,23H-porphine-2-propionate

Registry Numbers

CAS Registry Number

  • 84580-22-3

System Generated Number

  • 0084580223

Molecular Formulas

Molecular Formula

  • C34-H34-N4-O7.3K

Molecular Formula Fragments

  • C34-H34-N4-O7
  • COMPONENT
  • K

Structure Descriptors

InChI

1S/C34H34N4O7.3K/c1-6-18-15(3)23-11-24-16(4)20(8-9-29(40)41)32(37-24)21(10-30(42)43)33-31(34(44)45)17(5)25(38-33)12-27-19(7-2)22(14-39)28(36-27)13-26(18)35-23;;;/h6,11-14,16,20,35,38H,1,7-10H2,2-5H3,(H,40,41)(H,42,43)(H,44,45);;;/q;3*+1/b23-11-,24-11-,25-12-,26-13-,27-12-,28-13-,32-21-,33-21-;;;/t16-,20-;;;/m0.../s1

InChIKey

ZSFDGFSAUBRWAY-SKRBGUKPSA-N

Smiles

[K+].[K+].[K+].CCc1c(C=O)c2cc3[nH]c(cc4nc([C@@H](CCC(=O)O)[C@@H]4C)c(CC(=O)O)c5[nH]c(cc1n2)C(=C5C(=O)O)C)c(C)c3C=C