AG002ZOL

30315-93-6 | (S)-2-Amino-5-(3,3-dimethylguanidino)pentanoic acid

AG002ZOL

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CAS Number	30315-93-6
Catalog Number	AG002ZOL(AGN-PC-0O8QQH)
Chemical Name	(S)-2-Amino-5-(3,3-dimethylguanidino)pentanoic acid
IUPAC Name	(2S)-2-amino-5-[[amino(dimethylamino)methylidene]amino]pentanoic acid
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
InChI Key	YDGMGEXADBMOMJ-LURJTMIESA-N
MDL Number	MFCD00038406
Molecular Formula	C8H18N4O2
Molecular Weight	202.2541
SMILES	O=C(O)[C@@H](N)CCCNC(N(C)C)=N
Synonyms	asymmetric dimethylarginine, dimethyl-L-arginine, guanidino-N,N-dimethylarginine, N(G),N(G)-dimethylarginine, N(G)-dimethylarginine, N(G1),N(G1)-dimethylarginine, N,N-dimethylarginine, N,N-dimethylarginine, ADMA, Asymmetric dimethylarginine, Dimethyl-L-arginine, NG,NG-dimethyl-L-arginine, 30315-93-6, N(G)-Dimethylarginine, Guanidino-N,N-dimethylarginine, N(G),N(G)-Dimethylarginine, N(G1),N(G1)-Dimethylarginine, (S)-2-Amino-5-(3,3-dimethylguanidino)pentanoic acid, Lopac-D-4268, N(5)-((Dimethylamino)iminomethyl)-L-ornithine, N(omega),N(omega)-dimethyl-L-arginine, NG,NG-DIMETHYLARGININE HYDROCHLORIDE, CHEBI:17929, YDGMGEXADBMOMJ-LURJTMIESA-N, N5-[(Dimethylamino)iminomethyl]-L-ornithine, (2S)-2-amino-5-[(amino-dimethylamino-methylidene)amino]pentanoic acid, N(5)-[(dimethylamino)(imino)methyl]-L-ornithine, DA2, (2S)-2-amino-5-(1,1-dimethylcarbamimidamido)pentanoic acid, 65005-57-4, L-Ornithine, N5-((dimethylamino)iminomethyl)-, L-Arg(Me, Me)-OH (asymmetrical), NG,NG-DIMETHYL-L-ARGININE DIHYDROCHLORIDE, C8H18N4O2, NG-dimethylarginine, n-n-dimethylarginine, (e)-n5-[amino(dimethylamino)methylidene]-l-ornithine, NG,NG-dimethylarginine, n,n-dimethyl-l-arginine, AC1L3XDJ, AC1Q5QLH, L-NG,NG-dimethylarginine, Assymetric Dimethylarginine, Lopac0_000388, ADMA, 3, SCHEMBL196828, Assymetric Dimethyl-L-arginine, CHEMBL457530, GTPL5229, (2S)-2-amino-5-[[amino(dimethylamino)methylidene]amino]pentanoic acid, DTXSID6036758, SCHEMBL12094101, BDBM92901, CTK0H5814, N(G),N(G)-dimethyl-L-arginine, Nomega,Nomega-Dimethyl-L-arginine, Asymmetric Dimethylarginine (ADMA), Nomega,Nomega'-Dimethyl-L-arginine, ZINC1529718, HSCI1_000241, MFCD00038406, AKOS026674196, AKOS030240986, ACN-040877, CCG-204482, DB01686, NCGC00015343-01, NCGC00162138-01, NCGC00162138-02, HY-113216, LS-174297, CS-0059330, FT-0667316, N(5)-(N,N-dimethylcarbamimidoyl)-L-ornithine, N~5~-(N,N-dimethylcarbamimidoyl)-L-ornithine, C03626, N5-[(dimethylamino)(imino)methyl]-L-ornithine, 2-amino-5-(amino-dimethylamino-methylidene)amino-pentanoate, UNII-27JT06E6GR component YDGMGEXADBMOMJ-LURJTMIESA-N, UNII-63CV1GEK3Y component YDGMGEXADBMOMJ-LURJTMIESA-N, (2S)-2-amino-5-(N',N'-dimethylcarbamimidamido)pentanoic acid, 2-Amino-5-[(amino-dimethylaminomethylene)amino]pentanoic acid, (2S)-2-amino-5-{[(dimethylamino)(imino)methyl]amino}pentanoic acid, N,N-Dimethylarginine 2-amino-5-(3,3-dimethylguanidino)pentanoic acid l-arg(me, me)-oh (asymmetrical), UNII-63CV1GEK3Y, D02DQQ, 63CV1GEK3Y, KST-1A3715, N^G,N^G-Dimethylarginine hydrochloride, AR-1A7657, C8-H18-N4-O2, CID123831, 102783-24-4, 2-amino-5-(amino-dimethylamino-methylidene)amino-pentanoic acid, N5-[(Dimethylamino)iminomethyl]-L-ornithine, 97% - 1G 1g, 220805-22-1, 314-01-2, 63937-30-4,

Complexity	215
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	202.143g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	202.258g/mol
Monoisotopic Mass	202.143g/mol
Rotatable Bond Count	6
Topological Polar Surface Area	105A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-3.6

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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