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Substance Name: Calcium 2-ketogluconate
RN: 3470-37-9
UNII: 8K5SM7SI6Y
InChIKey: NNLOHLDVJGPUFR-JQTJLMCZSA-L

Molecular Formula

  • 2C6-H9-O7.Ca

Molecular Weight

  • 426.3382
 
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Names and Synonyms

Name of Substance

  • Calcium 2-ketogluconate

Synonyms

  • Calcium 2-keto-D-gluconate
  • Calcium 2-ketogluconate
  • Calcium 2-ketogluconate, (-)-
  • Calcium ketogluconate
  • Calcium ketogluconate [INCI]
  • D-Arabino-2-hexulosonic acid, calcium salt
  • D-Arabino-2-hexulosonic acid, calcium salt (2:1)
  • UNII-8K5SM7SI6Y

Registry Numbers

CAS Registry Number

  • 3470-37-9

FDA UNII

  • 8K5SM7SI6Y

System Generated Number

  • 0003470379

Structure Descriptors

InChI

1S/2C6H10O7.Ca/c2*7-1-2(8)3(9)4(10)5(11)6(12)13;/h2*2-4,7-10H,1H2,(H,12,13);/q;;+2/p-2/t2*2-,3-,4+;/m11./s1

InChIKey

NNLOHLDVJGPUFR-JQTJLMCZSA-L

Smiles

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