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- ChemComp-HAR: N-OMEGA-HYDROXY-L-ARGININE -

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Basic information

EntryDatabase: PDB chemical components / ID: HAR
NameName: N-omega-hydroxy-L-arginine

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Chemical information

Composition
Formula: C6H14N4O3 / Number of atoms: 27 / Formula weight: 190.2 / Formal charge: 0
Others

1dwv

ARG

Type: L-PEPTIDE LINKING / PDB classification: ATOMP / One letter code: R / Three letter code: HAR / Model coordinates PDB-ID: 1DWV / Parent comp.: ARG
History
Create componentJul 8, 1999
Modify descriptorJun 4, 2011
Modify backboneNov 3, 2023
External linksUniChem / ChemSpider / BindingDB / Brenda / ChEBI / ChEMBL / DrugBank / HMDB / Metabolights / Nikkaji / PubChem / PubChem_TPharma / SureChEMBL / ZINC / Wikipedia search / Google search

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Structure visualization

Structure viewerMolecule:
MolmilJmol/JSmol

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Details

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SMILES

ACDLabs 10.04O=C(O)C(N)CCCNC(=[N@H])NO
CACTVS 3.341N[CH](CCCNC(=N)NO)C(O)=O
OpenEye OEToolkits 1.5.0C(CC(C(=O)O)N)CNC(=N)NO

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SMILES CANONICAL

CACTVS 3.341N[C@@H](CCCNC(=N)NO)C(O)=O
OpenEye OEToolkits 1.5.0C(C[C@@H](C(=O)O)N)CNC(=N)NO

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InChI

InChI 1.03InChI=1S/C6H14N4O3/c7-4(5(11)12)2-1-3-9-6(8)10-13/h4,13H,1-3,7H2,(H,11,12)(H3,8,9,10)/t4-/m0/s1

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InChIKey

InChI 1.03FQWRAVYMZULPNK-BYPYZUCNSA-N

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SYSTEMATIC NAME

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

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