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Substance Name: Zirconium, tetrakis(D-gluconato)-
RN: 70983-41-4
InChIKey: BHVQLRGKBUDAFF-FSCNPAMSSA-J

Molecular Formula

  • C24-H44-O28-Zr

Molecular Weight

  • 871.8076
 
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Names and Synonyms

Synonyms

  • EINECS 275-084-7
  • Zirconium gluconate

Systematic Names

  • Tetra(D-gluconato)zirconium
  • Zirconium gluconate
  • Zirconium, tetrakis(D-gluconato)-

Registry Numbers

CAS Registry Number

  • 70983-41-4

System Generated Number

  • 0070983414

Structure Descriptors

InChI

1S/4C6H12O7.Zr/c4*7-1-2(8)3(9)4(10)5(11)6(12)13;/h4*2-5,7-11H,1H2,(H,12,13);/q;;;;+4/p-4/t4*2-,3-,4+,5-;/m1111./s1

InChIKey

BHVQLRGKBUDAFF-FSCNPAMSSA-J

Smiles

C([C@H]([C@H]([C@@H]([C@H](C(=O)O[Zr](OC(=O)[C@@H]([C@H]([C@@H]([C@@H](CO)O)O)O)O)(OC(=O)[C@@H]([C@H]([C@@H]([C@@H](CO)O)O)O)O)OC(=O)[C@@H]([C@H]([C@@H]([C@@H](CO)O)O)O)O)O)O)O)O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 intraperitoneal 247mg/kg (247mg/kg)   National Technical Information Service. Vol. AEC-TR-6710,