Chemical Components in the PDB

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MF8 : Summary

Code

MF8

One-letter code

X

Molecule name

Metformin

Synonyms

N,N-Dimethylimidodicarbonimidic diamide

Systematic names

ProgramVersionName
OpenEye OEToolkits 1.7.6 3-carbamimidoyl-1,1-dimethyl-guanidine

Formula

C4 H11 N5

Formal charge

0

Molecular weight

129.164 Da

SMILES

TypeProgramVersionDescriptor
SMILES CACTVS 3.385 CN(C)C(=N)NC(N)=N
SMILES OpenEye OEToolkits 1.7.6 CN(C)C(=N)NC(=N)N
Canonical SMILES CACTVS 3.385 CN(C)C(=N)NC(N)=N
Canonical SMILES OpenEye OEToolkits 1.7.6 [H]/N=C(/N)\N/C(=N\[H])/N(C)C

IUPAC InChI

InChI=1S/C4H11N5/c1-9(2)4(7)8-3(5)6/h1-2H3,(H5,5,6,7,8)

IUPAC InChI key

XZWYZXLIPXDOLR-UHFFFAOYSA-N
MF8

wwPDB Information

Atom count

20 (9 without Hydrogen)

Polymer type

Bound ligand

Type description

non-polymer

Type code

HETAIN

Is modified

No

Standard parent

Not Assigned

Defined at

2016-05-25

Last modified at

2017-06-02

Status

Released

Obsoleted

Not Assigned