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N,N-Dimethylarginine

PubChem CID: 123831

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Compound Synonyms N,N-dimethylarginine, ADMA, Dimethyl-L-arginine, 30315-93-6, Asymmetric dimethylarginine, NG,NG-dimethyl-L-arginine, N(G)-Dimethylarginine, N(G),N(G)-Dimethylarginine, Guanidino-N,N-dimethylarginine, N(G1),N(G1)-Dimethylarginine, NG,NG-dimethylarginine, (S)-2-Amino-5-(3,3-dimethylguanidino)pentanoic acid, N(5)-((Dimethylamino)iminomethyl)-L-ornithine, CHEBI:17929, L-NG,NG-dimethylarginine, 63CV1GEK3Y, NG-dimethylarginine, N(omega),N(omega)-dimethyl-L-arginine, (2S)-2-amino-5-[(amino-dimethylamino-methylidene)amino]pentanoic acid, (2S)-2-amino-5-[[amino(dimethylamino)methylidene]amino]pentanoic acid, CHEMBL457530, 65005-57-4, Nomega,Nomega-Dimethyl-L-arginine, DTXSID401017725, Nomega,Nomega'-Dimethyl-L-arginine, N(5)-[(dimethylamino)(imino)methyl]-L-ornithine, NG,NG-DIMETHYLARGININE HYDROCHLORIDE, (2S)-2-amino-5-(1,1-dimethylcarbamimidamido)pentanoic acid, NG,NG-DIMETHYL-L-ARGININE DIHYDROCHLORIDE, OMEGA-N,OMEGA-N-DIMETHYL-L-ARGININE, N(5)-(N,N-dimethylcarbamimidoyl)-L-ornithine, 2-amino-5-(amino-dimethylamino-methylidene)amino-pentanoate, (2S)-2-amino-5-(N',N'-dimethylcarbamimidamido)pentanoic acid, (2S)-2-amino-5-{[(dimethylamino)(imino)methyl]amino}pentanoic acid, N(5)-((dimethylamino)(imino)methyl)-L-ornithine, Lopac-D-4268, UNII-63CV1GEK3Y, NG,NG-Dimethylarginine-d6 Dihydrochloride, (2S)-2-amino-5-(((dimethylamino)(imino)methyl)amino)pentanoic acid, (2S)-2-amino-5-((E)-(amino(dimethylamino)methylidene)amino)pentanoic acid, (2S)-2-amino-5-[(E)-[amino(dimethylamino)methylidene]amino]pentanoic acid, (2S)-2-amino-5-{[amino(dimethylamino)methylidene]amino}pentanoic acid, N(G),N(G)-dimethyl-L-arginine, L-Arg(Me, Me)-OH (asymmetrical), n-n-dimethylarginine, MFCD00038406, Assymetric Dimethylarginine, asymmetrical-dimethylarginine, Lopac0_000388, ADMA, 3, N,N-DIMETHYL-ARGININE, 2-amino-5-(amino-dimethylamino-methylidene)amino-pentanoic acid, SCHEMBL196828, Assymetric Dimethyl-L-arginine, GTPL5229, DTXCID4016758, SCHEMBL12094101, BDBM92901, Asymmetric Dimethylarginine (ADMA), BDBM50626247, HSCI1_000241, MSK001033, AKOS026674196, AKOS030240986, CCG-204482, DB01686, Guanidino-N(1),N(1)-Dimethylarginine, SDCCGSBI-0050375.P002, NCGC00015343-01, NCGC00162138-01, NCGC00162138-02, DA-74890, 1ST001033, HY-113216, CS-0059330, N5-[(Dimethylamino)iminomethyl]-L-ornithine, NS00068530, N~5~-(N,N-dimethylcarbamimidoyl)-L-ornithine, C03626, F16326, N5-[(dimethylamino)(imino)methyl]-L-ornithine, Q752685, (S)-2-Amino-5-(3,3-dimethylguanidino)pentanoicacid, BRD-K36269323-300-02-6
Topological Polar Surface Area 105.0
Hydrogen Bond Donor Count 3.0
Heavy Atom Count 14.0
Description Isolated from broad bean seeds (Vicia faba). NG,NG-Dimethyl-L-arginine is found in many foods, some of which are yellow wax bean, spinach, green zucchini, and white cabbage.
Isotope Atom Count 0.0
Molecular Complexity 215.0
Database Name cmaup_ingredients;fooddb_chem_all;npass_chem_all;pubchem
Defined Atom Stereocenter Count 1.0
Enzyme Uniprot Id O95865
Uniprot Id O94760, O08557, P56965, P19838, P16473, P33261, Q96KQ7, O89049, P39748, P15289, n.a., P0DTD1
Iupac Name (2S)-2-amino-5-[[amino(dimethylamino)methylidene]amino]pentanoic acid
Prediction Hob 1.0
Class Carboxylic acids and derivatives
Target Id NPT163, NPT210, NPT213
Xlogp -3.6
Superclass Organic acids and derivatives
Subclass Amino acids, peptides, and analogues
Molecular Formula C8H18N4O2
Prediction Swissadme 0.0
Inchi Key YDGMGEXADBMOMJ-LURJTMIESA-N
Fcsp3 0.75
Logs -1.441
Rotatable Bond Count 6.0
State Solid
Logd -1.277
Synonyms 2-amino-5-(amino-dimethylamino-Methylidene)amino-pentanoate, 2-amino-5-(amino-dimethylamino-Methylidene)amino-pentanoic acid, ADMA, Asymmetric dimethylarginine, Dimethyl-L-arginine, Guanidino-N,N-dimethylarginine, N,N-dimethylarginine, N(5)-((dimethylamino)iminomethyl)-L-ornithine, N(5)-(N,N-dimethylcarbamimidoyl)-L-ornithine, N(g)-Dimethylarginine, N(g),N(g)-Dimethylarginine, N(g1),N(g1)-Dimethylarginine, N(Omega),N(omega)-dimethyl-L-arginine, N5-(N,N-Dimethylamidino)ornithine, 8CI, N5-[(Dimethylamino)iminomethyl]ornithine, 9CI, NG-Dimethylarginine, NG,NG-Dimethyl-L-arginine, NG,NG-Dimethylarginine, NG,NG-Dimethylarginine, L-form, Nomega,nomega'-dimethyl-L-arginine
Substituent Name D-alpha-amino acid, Amino fatty acid, Fatty acyl, Fatty acid, Tertiary amine, Guanidine, Carboximidamide, Monocarboxylic acid or derivatives, Carboxylic acid, Hydrocarbon derivative, Primary amine, Organooxygen compound, Organonitrogen compound, Primary aliphatic amine, Imine, Carbonyl group, Amine, Aliphatic acyclic compound
Compound Name N,N-Dimethylarginine
Kingdom Organic compounds
Prediction Hob Swissadme 0.0
Exact Mass 202.143
Formal Charge 0.0
Monoisotopic Mass 202.143
Hydrogen Bond Acceptor Count 4.0
Molecular Weight 202.25
Covalent Unit Count 1.0
Total Atom Stereocenter Count 1.0
Total Bond Stereocenter Count 0.0
Esol 1.6486004000000003
Inchi InChI=1S/C8H18N4O2/c1-12(2)8(10)11-5-3-4-6(9)7(13)14/h6H,3-5,9H2,1-2H3,(H2,10,11)(H,13,14)/t6-/m0/s1
Smiles CN(C)C(=NCCC[C@@H](C(=O)O)N)N
Nring 0.0
Defined Bond Stereocenter Count 0.0

  • 1. Outgoing r'ship FOUND_IN to/from Allium Cepa (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
  • 2. Outgoing r'ship FOUND_IN to/from Anethum Graveolens (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
  • 3. Outgoing r'ship FOUND_IN to/from Avena Sativa (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
  • 4. Outgoing r'ship FOUND_IN to/from Beta Vulgaris (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
  • 5. Outgoing r'ship FOUND_IN to/from Brassica Oleracea (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
  • 6. Outgoing r'ship FOUND_IN to/from Brassica Rapa (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
  • 7. Outgoing r'ship FOUND_IN to/from Capsicum Annuum (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
  • 8. Outgoing r'ship FOUND_IN to/from Cucumis Sativus (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
  • 9. Outgoing r'ship FOUND_IN to/from Cucurbita Maxima (Plant) Rel Props:Source_db:npass_chem_all
  • 10. Outgoing r'ship FOUND_IN to/from Cucurbita Pepo (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
  • 11. Outgoing r'ship FOUND_IN to/from Daucus Carota (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
  • 12. Outgoing r'ship FOUND_IN to/from Hordeum Vulgare (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
  • 13. Outgoing r'ship FOUND_IN to/from Lactuca Sativa (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
  • 14. Outgoing r'ship FOUND_IN to/from Pastinaca Sativa (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
  • 15. Outgoing r'ship FOUND_IN to/from Phaseolus Vulgaris (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
  • 16. Outgoing r'ship FOUND_IN to/from Prunus Tomentosa (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
  • 17. Outgoing r'ship FOUND_IN to/from Rubus Idaeus (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
  • 18. Outgoing r'ship FOUND_IN to/from Secale Cereale (Plant) Rel Props:Source_db:npass_chem_all
  • 19. Outgoing r'ship FOUND_IN to/from Solanum Melongena (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
  • 20. Outgoing r'ship FOUND_IN to/from Solanum Tuberosum (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
  • 21. Outgoing r'ship FOUND_IN to/from Spinacia Oleracea (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
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