Trisodium isocitrate

CAS Registry Number®

1637-73-6
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CAS Name

Trisodium isocitrate

Molecular Formula

C6H8O7.3Na

Cite this Page

Trisodium isocitrate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?ref=1637-73-6 (retrieved 2022-01-25) (CAS RN: 1637-73-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C6H8O7.3Na/c7-3(8)1-2(5(10)11)4(9)6(12)13;;;/h2,4,9H,1H2,(H,7,8)(H,10,11)(H,12,13);;;

InChIKey

InChIKey=KOCHEPPBLHXCPQ-UHFFFAOYSA-N

SMILES

C(C(C(O)=O)O)(CC(O)=O)C(O)=O.[Na]

Canonical SMILES

[Na].O=C(O)CC(C(=O)O)C(O)C(=O)O

Other Names for this Substance

  • Pentaric acid, 3-carboxy-2,3-dideoxy-, sodium salt (1:3)
  • Isocitric acid, trisodium salt
  • Pentaric acid, 3-carboxy-2,3-dideoxy-, trisodium salt
  • Sodium isocitrate
  • Trisodium isocitrate

Deleted or Replaced CAS Registry Numbers

13167-87-8