Chemical Components in the PDB

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NMK : Summary

Code

NMK

One-letter code

X

Molecule name

N-methyl Lysine

Systematic names

ProgramVersionName
OpenEye OEToolkits 2.0.6 [(5~{S})-5-(methylamino)-6-oxidanyl-6-oxidanylidene-hexyl]azanium

Formula

C7 H17 N2 O2

Formal charge

1

Molecular weight

161.222 Da

SMILES

TypeProgramVersionDescriptor
SMILES CACTVS 3.385 CN[CH](CCCC[NH3+])C(O)=O
SMILES OpenEye OEToolkits 2.0.6 CNC(CCCC[NH3+])C(=O)O
Canonical SMILES CACTVS 3.385 CN[C@@H](CCCC[NH3+])C(O)=O
Canonical SMILES OpenEye OEToolkits 2.0.6 CN[C@@H](CCCC[NH3+])C(=O)O

IUPAC InChI

InChI=1S/C7H16N2O2/c1-9-6(7(10)11)4-2-3-5-8/h6,9H,2-5,8H2,1H3,(H,10,11)/p+1/t6-/m0/s1

IUPAC InChI key

OLYPWXRMOFUVGH-LURJTMIESA-O
NMK

wwPDB Information

Atom count

28 (11 without Hydrogen)

Polymer type

Bound ligand

Type description

NON-POLYMER

Type code

HETAIN

Is modified

No

Standard parent

Not Assigned

Defined at

2018-10-10

Last modified at

2023-11-03

Status

Released

Obsoleted

Not Assigned