Chemical Components in the PDB

pdbe.org/chem
spacer

ARM : Summary

Code

ARM

One-letter code

R

Molecule name

DEOXY-METHYL-ARGININE

Systematic names

ProgramVersionName
ACDLabs 10.04 1-[(4S)-4-amino-5-oxohexyl]guanidine
OpenEye OEToolkits 1.5.0 1-[(4S)-4-amino-5-oxo-hexyl]guanidine

Formula

C7 H16 N4 O

Formal charge

0

Molecular weight

172.228 Da

SMILES

TypeProgramVersionDescriptor
SMILES ACDLabs 10.04 O=C(C)C(N)CCCNC(=[N@H])N
SMILES CACTVS 3.341 CC(=O)[CH](N)CCCNC(N)=N
SMILES OpenEye OEToolkits 1.5.0 CC(=O)C(CCCNC(=N)N)N
Canonical SMILES CACTVS 3.341 CC(=O)[C@@H](N)CCCNC(N)=N
Canonical SMILES OpenEye OEToolkits 1.5.0 CC(=O)[C@H](CCCNC(=N)N)N

IUPAC InChI

InChI=1S/C7H16N4O/c1-5(12)6(8)3-2-4-11-7(9)10/h6H,2-4,8H2,1H3,(H4,9,10,11)/t6-/m0/s1

IUPAC InChI key

GCCQNSQKSSOQIR-LURJTMIESA-N

Is part of

YVP
ARM

wwPDB Information

Atom count

28 (12 without Hydrogen)

Polymer type

Amino Acid

Type description

L-PEPTIDE LINKING

Type code

ATOMP

Is modified

Yes

Standard parent

ARG

Defined at

1999-07-08

Last modified at

2023-11-03

Status

Released

Obsoleted

Not Assigned