Ketcher 12041510042D 1   1.00000     0.00000     0

 10  8  0     0  0            999 V2000
    6.5532   -3.8448    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.4193   -5.3448    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.4193   -4.3448    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2852   -3.8448    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.1512   -5.3448    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.1512   -4.3448    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0173   -2.8448    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0173   -3.8448    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   10.8833   -4.3448    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5304   -6.3014    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
  1  3  1  0     0  0
  3  2  2  0     0  0
  3  4  1  0     0  0
  4  6  1  0     0  0
  6  5  2  0     0  0
  6  8  1  0     0  0
  8  7  1  0     0  0
  8  9  1  0     0  0
M  END
> <ID>
CHEBI:6802

> <NAME>
metformin hydrochloride

> <DEFINITION>
A hydrochloride resulting from the reaction of metformin with one molar equivalent of hydrogen chloride.

> <STAR>
3

> <SECONDARY_ID>
CHEBI:90684

> <SYNONYM>
N1,N1-Dimethylbiguanide; N,N-Dimethylbiguanide hydrochloride; Metiguanide monohydrochloride; Metformin monohydrochloride; Metformin HCl; Dimethylbiguanide hydrochloride; 1,1-Dimethylbiguanide monohydrochloride; 1,1-Dimethylbiguanide hydrochloride

> <IUPAC_NAME>
N,N-dimethylimidodicarbonimidic diamide hydrochloride

> <BRAND_NAME>
Glucophage

> <FORMULA>
C4H12ClN5

> <MASS>
165.625

> <MONOISOTOPIC_MASS>
165.07812

> <CHARGE>
0

> <SMILES>
NC(=N)NC(=N)N(C)C.Cl

> <INCHI>
InChI=1S/C4H11N5.ClH/c1-9(2)4(7)8-3(5)6;/h1-2H3,(H5,5,6,7,8);1H

> <INCHIKEY>
OETHQSJEHLVLGH-UHFFFAOYSA-N

> <CAS_REGISTRY_NUMBER>
1115-70-4

> <REAXYS_REGISTRY_NUMBER>
3626131

> <CHEMIDPLUS>
1115-70-4

> <DRUGBANK_ACCESSION>
DB00331

> <KEGG_DRUG_ACCESSION>
D00944

> <WIKIPEDIA_ACCESSION>
Metformin

> <PUBMED_CITATION>
24621340; 25281145; 25463179; 25720824; 25935176; 25978011; 26373206; 26394019; 26454593

$$$$