Calcium pangamate

CAS Registry Number®

20310-61-6

CAS Name

Calcium pangamate

Molecular Formula

C10H19NO8.1/2Ca

Cite this Page

Calcium pangamate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=20310-61-6 (retrieved 2024-11-22) (CAS RN: 20310-61-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C10H19NO8.Ca/c1-11(2)3-6(13)19-4-5(12)7(14)8(15)9(16)10(17)18;/h5,7-9,12,14-16H,3-4H2,1-2H3,(H,17,18);/t5-,7-,8+,9-;/m1./s1

InChIKey

InChIKey=PPYQJOCYELSGPV-CKDSBIORSA-N

SMILES

[C@H]([C@@H]([C@@H](COC(CN(C)C)=O)O)O)([C@H](C(O)=O)O)O.[Ca]

Canonical SMILES

[Ca].O=C(O)C(O)C(O)C(O)C(O)COC(=O)CN(C)C

Other Names for this Substance

  • Glycine, N,N-dimethyl-, 6-ester with D-gluconic acid, calcium salt (2:1)
  • Gluconic acid, 6-ester with N,N-dimethylglycine, calcium salt (2:1), D-
  • D-Gluconic acid, 6-ester with N,N-dimethylglycine, calcium salt (2:1)
  • Gluconic acid, 6-ester with N,N-dimethylglycine, calcium salt
  • Pangamic acid calcium salt

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Deleted or Replaced CAS Registry Numbers

11041-98-8