Chemical Components in the PDB

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NMM : Summary

Code

NMM

One-letter code

R

Molecule name

(2S)-2-amino-5-[(N-methylcarbamimidoyl)amino]pentanoic acid

Synonyms

L-NMMA

Systematic names

ProgramVersionName
ACDLabs 10.04 N~5~-(N-methylcarbamimidoyl)-L-ornithine
OpenEye OEToolkits 1.5.0 (2S)-2-amino-5-[(N-methylcarbamimidoyl)amino]pentanoic acid

Formula

C7 H16 N4 O2

Formal charge

0

Molecular weight

188.228 Da

SMILES

TypeProgramVersionDescriptor
SMILES ACDLabs 10.04 O=C(O)C(N)CCCNC(=[N@H])NC
SMILES CACTVS 3.341 CNC(=N)NCCC[CH](N)C(O)=O
SMILES OpenEye OEToolkits 1.5.0 [H]N=C(NC)NCCCC(C(=O)O)N
Canonical SMILES CACTVS 3.341 CNC(=N)NCCC[C@H](N)C(O)=O
Canonical SMILES OpenEye OEToolkits 1.5.0 [H]/N=C(/NC)\NCCC[C@@H](C(=O)O)N

IUPAC InChI

InChI=1S/C7H16N4O2/c1-10-7(9)11-4-2-3-5(8)6(12)13/h5H,2-4,8H2,1H3,(H,12,13)(H3,9,10,11)/t5-/m0/s1

IUPAC InChI key

NTNWOCRCBQPEKQ-YFKPBYRVSA-N
NMM

wwPDB Information

Atom count

29 (13 without Hydrogen)

Polymer type

Amino Acid

Type description

L-PEPTIDE LINKING

Type code

ATOMP

Is modified

Yes

Standard parent

ARG

Defined at

2005-12-28

Last modified at

2023-11-03

Status

Released

Obsoleted

Not Assigned