Marvin  11251015442D          

  7  4  0  0  0  0            999 V2000
   20.1423  -15.4870    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
   20.1423  -14.6620    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   20.1423  -13.8370    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
   20.9673  -14.6620    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.3173  -14.6620    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   20.9079  -15.4726    0.0000 Li  0  3  0  0  0  0  0  0  0  0  0  0
   19.3438  -15.5158    0.0000 Li  0  3  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  2  4  2  0  0  0  0
  2  5  2  0  0  0  0
M  CHG  4   1  -1   3  -1   6   1   7   1
M  END
> <ID>
CHEBI:53474

> <NAME>
lithium sulfate

> <DEFINITION>
A metal sulfate in which the counterion is lithium and the ratio of lithium to sulfate is 2:1.

> <STAR>
3

> <SYNONYM>
Lithium sulphate; Lithium sulfate; Lithiophor; Li2SO4; Dilthium sulfate

> <IUPAC_NAME>
dilithium sulfate

> <FORMULA>
Li2O4S

> <MASS>
109.94500

> <MONOISOTOPIC_MASS>
109.98374

> <CHARGE>
0

> <SMILES>
[Li+].[Li+].[O-]S([O-])(=O)=O

> <INCHI>
InChI=1S/2Li.H2O4S/c;;1-5(2,3)4/h;;(H2,1,2,3,4)/q2*+1;/p-2

> <INCHIKEY>
INHCSSUBVCNVSK-UHFFFAOYSA-L

> <CAS_REGISTRY_NUMBER>
10377-48-7

> <GMELIN_REGISTRY_NUMBER>
6364

> <REAXYS_REGISTRY_NUMBER>
11242643

> <CHEMIDPLUS>
10377-48-7

> <KEGG_DRUG_ACCESSION>
D08137

> <NIST_CHEMISTRY_WEBBOOK>
10377-48-7

> <PUBMED_CITATION>
2469014; 8991630

$$$$