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Substance Name: Nickel 2-oxopentanedioate
RN: 132428-46-7
InChIKey: AQWDIPGRUBHKCW-UHFFFAOYSA-L

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C11-H21-N-Ni-O9-S.Cl-H

Molecular Weight

  • 438.5048
 
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Names and Synonyms

Results Name

  • Nickel 2-oxopentanedioate

Synonym

  • Diaquo-alpha-ketoglutarato-O,O(sup alpha)-chloro-S-methylmethioninato-O,N-nickel(II)

Systematic Names

  • Nickel, ((3-amino-3-carboxypropyl)dimethylsulfoniumato-N,O)diaqua(2-oxopentanedioato(2-)-O(sup 1),O(sup 2))-, hydrochloride
  • Nickel, ((3-amino-3-carboxypropyl)dimethylsulfoniumato-N,O)diaqua(2-oxopentanedioato(2-)-O1,O2)-, hydrochloride

Registry Numbers

CAS Registry Number

  • 132428-46-7

System Generated Number

  • 0132428467

Molecular Formulas

Molecular Formula

  • C11-H21-N-Ni-O9-S.Cl-H

Molecular Formula Fragments

  • C11-H21-N-Ni-O9-S
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C6H13NO2S.C5H6O5.ClH.Ni.2H2O/c1-10(2)4-3-5(7)6(8)9;6-3(5(9)10)1-2-4(7)8;;;;/h5H,3-4,7H2,1-2H3;1-2H2,(H,7,8)(H,9,10);1H;;2*1H2/q;;;+2;;/p-2

InChIKey

AQWDIPGRUBHKCW-UHFFFAOYSA-L

Smiles

C[S+](C)CCC(C(=O)[O-])N.C(CC(=O)[O-])C(=O)C(=O)[O-].O.O.Cl.[Ni+2]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 30mg/kg (30mg/kg)   Pharmaceutical Chemistry Journal Vol. 24, Pg. 664, 1990.