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Nitroarginine

CAT: 0931-T9376-02Size: 5 gDry Ice: NoHazardous: No
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CAT#:0931-T9376-02Size:5 g
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CAS Number
2149-70-4
Target
NO Synthase
Related Pathways
Immunology/Inflammation
Purity
0.9985
Bioactivity
Nitroarginine (N'-Nitro-L-arginine) is a competitive inhibitor of nitric oxide synthase which causes the selective reduction of blood flow to tumor cells[1].
Smiles
N[C@@H](CCCNC(=N)N[N+]([O-])=O)C(O)=O
Molecular Formula
C6H13N5O4
Molecular Weight
219.2
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Nomega-nitro-L-arginine

N(gamma)-nitro-L-arginine is an L-arginine derivative that is L-arginine in which the terminal nitrogen of the guanidyl group is replaced by a nitro group. It is a member of guanidines, a N-nitro compound, a non-proteinogenic L-alpha-amino acid and a L-arginine derivative.

CAS Number2149-70-4
PubChem CID440005
IUPAC Name(2S)-2-amino-5-[[amino(nitramido)methylidene]amino]pentanoic acid
Molecular FormulaC6H13N5O4
Molecular Weight219.20
XLogP-3.6
Topological Polar Surface Area160
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count6
Rotatable Bond Count6
Heavy Atom Count15
Formal Charge0
Complexity261
SMILES
C(C[C@@H](C(=O)O)N)CN=C(N)N[N+](=O)[O-]
InChI
InChI=1S/C6H13N5O4/c7-4(5(12)13)2-1-3-9-6(8)10-11(14)15/h4H,1-3,7H2,(H,12,13)(H3,8,9,10)/t4-/m0/s1
InChIKey
MRAUNPAHJZDYCK-BYPYZUCNSA-N
Chemical Structure
2D Structure
2D structure of Nomega-nitro-L-arginine
CAS: 2149-70-4
CID: 440005
Formula: C6H13N5O4
MW: 219.20
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight219.20
XLogP3-3.6
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count6
Rotatable Bond Count6
Exact Mass219.09675391
Monoisotopic Mass219.09675391
Topological Polar Surface Area160 Ų
Heavy Atom Count15
Formal Charge0
Complexity261
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes