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Substance Name: D-threo-2,5-Hexodiulosonic acid, calcium salt (2:1)
RN: 24940-63-4
InChIKey: RKFLKNFLAJISPF-OGXRZFKVSA-L

Molecular Formula

  • C6-H8-O7.1/2Ca

Molecular Weight

  • 422.307
 
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Names and Synonyms

Synonyms

  • Calcium 2,5-diketogluconic acid
  • EINECS 246-542-3

Systematic Names

  • Calcium bis(hydrogen D-threo-hexo-2,5-diulosonate)
  • D-threo-2,5-Hexodiulosonic acid, calcium salt (2:1)

Registry Numbers

CAS Registry Number

  • 24940-63-4

System Generated Number

  • 0024940634

Molecular Formulas

Molecular Formula

  • C6-H8-O7.1/2Ca

Molecular Formula Fragments

  • C6-H8-O7
  • Ca
  • COMPONENT

Structure Descriptors

InChI

1S/2C6H8O7.Ca/c2*7-1-2(8)3(9)4(10)5(11)6(12)13;/h2*3-4,7,9-10H,1H2,(H,12,13);/q;;+2/p-2/t2*3-,4+;/m11./s1

InChIKey

RKFLKNFLAJISPF-OGXRZFKVSA-L

Smiles

[O-]C(=O)C(=O)[C@@H](O)[C@@H](C(=O)CO)O.[O-]C(=O)C(=O)[C@@H](O)[C@H](O)C(=O)CO.[Ca+2]