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Substance Name: 1-Propanesulfonic acid, 3-(3-hydroxy-4-(3-(3-hydroxy-4-methoxyphenyl)-1-oxopropyl)-5-methoxyphenoxy)-, monopotassium salt
RN: 63240-65-3
InChIKey: NEDJHMXEFSOAQI-UHFFFAOYSA-M

Molecular Formula

  • C20-H24-O9-S.K

Molecular Weight

  • 478.557
 
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Names and Synonyms

  • 1-Propanesulfonic acid, 3-(3-hydroxy-4-(3-(3-hydroxy-4-methoxyphenyl)-1-oxopropyl)-5-methoxyphenoxy)-, monopotassium salt

Registry Numbers

CAS Registry Number

  • 63240-65-3

System Generated Number

  • 0063240653

Molecular Formulas

Molecular Formula

  • C20-H24-O9-S.K

Molecular Formula Fragments

  • C20-H24-O9-S
  • COMPONENT
  • K

Structure Descriptors

InChI

1S/C20H24O9S.K/c1-27-18-7-5-13(10-16(18)22)4-6-15(21)20-17(23)11-14(12-19(20)28-2)29-8-3-9-30(24,25)26;/h5,7,10-12,22-23H,3-4,6,8-9H2,1-2H3,(H,24,25,26);/q;+1/p-1

InChIKey

NEDJHMXEFSOAQI-UHFFFAOYSA-M

Smiles

[K+].C(CCOc1cc(c(c(c1)OC)C(CCc1cc(c(cc1)OC)O)=O)O)S(=O)(=O)[O-]